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{
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{
"id": "mp-1180698",
"created_at": "2022-09-04T14:46:29.456618Z",
"structure_string": "Li1 Co1 C8 N8 O12\n1.0\n4.105966 -7.111741 0.000000\n4.105966 7.111741 0.000000\n0.000000 0.000000 7.261913\nLi Co C N O\n1 1 8 8 12\ndirect\n0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Co\n0.815731 0.407866 0.369700 C\n0.592134 0.184269 0.369700 C\n0.592134 0.407866 0.369700 C\n0.184269 0.592134 0.630300 C\n0.407866 0.815731 0.630300 C\n0.407866 0.592134 0.630300 C\n0.666667 0.333333 0.517171 C\n0.333333 0.666667 0.482829 C\n0.235337 0.117668 0.842032 N\n0.882332 0.764663 0.842032 N\n0.882332 0.117668 0.842032 N\n0.764663 0.882332 0.157968 N\n0.117668 0.235337 0.157968 N\n0.117668 0.882332 0.157968 N\n0.666667 0.333333 0.228976 N\n0.333333 0.666667 0.771024 N\n0.230865 0.115433 0.671839 O\n0.884567 0.769135 0.671839 O\n0.884567 0.115433 0.671839 O\n0.769135 0.884567 0.328161 O\n0.115433 0.230865 0.328161 O\n0.115433 0.884567 0.328161 O\n0.379414 0.189707 0.934671 O\n0.810293 0.620586 0.934671 O\n0.810293 0.189707 0.934671 O\n0.620586 0.810293 0.065329 O\n0.189707 0.379414 0.065329 O\n0.189707 0.810293 0.065329 O\n",
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"formula_full": "Li1 Co1 C8 N8 O12",
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{
"id": "mp-1224443",
"created_at": "2022-09-04T14:46:36.992368Z",
"structure_string": "K6 Er8 Cu10 Te20\n1.0\n4.328846 0.000000 0.000000\n0.000000 16.550669 0.000000\n0.000000 0.000000 17.668360\nK Er Cu Te\n6 8 10 20\ndirect\n0.500000 0.079994 0.335968 K\n0.500000 0.421174 0.662142 K\n0.000000 0.578826 0.162142 K\n0.000000 0.920006 0.835968 K\n0.500000 0.249648 0.498923 K\n0.000000 0.750352 0.998923 K\n0.500000 0.536198 0.447718 Er\n0.500000 0.959053 0.554567 Er\n0.000000 0.040947 0.054567 Er\n0.000000 0.463802 0.947718 Er\n0.500000 0.314826 0.214055 Er\n0.500000 0.182298 0.786073 Er\n0.000000 0.817702 0.286073 Er\n0.000000 0.685174 0.714055 Er\n0.500000 0.591903 0.845567 Cu\n0.500000 0.910478 0.154542 Cu\n0.000000 0.089522 0.654542 Cu\n0.000000 0.408097 0.345567 Cu\n0.500000 0.312362 0.042618 Cu\n0.500000 0.185315 0.959162 Cu\n0.000000 0.814685 0.459162 Cu\n0.000000 0.687638 0.542618 Cu\n0.500000 0.656363 0.309141 Cu\n0.000000 0.343637 0.809141 Cu\n0.500000 0.577318 0.994952 Te\n0.500000 0.922408 0.006191 Te\n0.000000 0.077592 0.506191 Te\n0.000000 0.422682 0.494952 Te\n0.500000 0.880703 0.397385 Te\n0.500000 0.619007 0.600879 Te\n0.000000 0.380993 0.100879 Te\n0.000000 0.119297 0.897385 Te\n0.500000 0.482013 0.286233 Te\n0.500000 0.021714 0.713875 Te\n0.000000 0.978286 0.213875 Te\n0.000000 0.517987 0.786233 Te\n0.500000 0.334543 0.894383 Te\n0.500000 0.163349 0.105416 Te\n0.000000 0.836651 0.605416 Te\n0.000000 0.665457 0.394383 Te\n0.500000 0.746117 0.185742 Te\n0.500000 0.748342 0.814568 Te\n0.000000 0.251658 0.314568 Te\n0.000000 0.253883 0.685742 Te\n",
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{
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"structure_string": "Ga7 Cu3 Se12\n1.0\n1.959399 10.423879 0.000000\n-1.959399 10.423879 0.000000\n0.000000 8.898740 13.028226\nGa Cu Se\n7 3 12\ndirect\n0.003549 0.003549 0.997305 Ga\n0.003395 0.003395 0.498662 Ga\n0.340295 0.340295 0.248297 Ga\n0.669138 0.669138 0.238776 Ga\n0.671475 0.671475 0.994169 Ga\n0.995056 0.995056 0.754492 Ga\n0.331500 0.331500 0.491143 Ga\n0.665743 0.665743 0.501724 Cu\n0.329693 0.329693 0.758032 Cu\n0.665572 0.665572 0.756180 Cu\n0.412335 0.412335 0.058621 Se\n0.751092 0.751092 0.060170 Se\n0.079171 0.079171 0.310076 Se\n0.079111 0.079111 0.071541 Se\n0.412496 0.412496 0.568127 Se\n0.419640 0.419640 0.310186 Se\n0.744661 0.744661 0.569905 Se\n0.747783 0.747783 0.314497 Se\n0.084737 0.084737 0.810476 Se\n0.085479 0.085479 0.562320 Se\n0.412666 0.412666 0.818294 Se\n0.750956 0.750956 0.810519 Se\n",
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{
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"structure_string": "K8 Na16 Zn24 P24 O96\n1.0\n8.954652 -15.509912 0.000000\n8.954652 15.509912 0.000000\n0.000000 0.000000 8.299363\nK Na Zn P O\n8 16 24 24 96\ndirect\n0.000000 0.000000 0.343611 K\n0.000000 0.000000 0.843611 K\n0.999183 0.501930 0.328450 K\n0.497253 0.999183 0.828450 K\n0.501930 0.502747 0.828450 K\n0.498070 0.497253 0.328450 K\n0.502747 0.000817 0.328450 K\n0.000817 0.498070 0.828450 K\n0.322149 0.152831 0.810201 Na\n0.169318 0.322149 0.310201 Na\n0.152831 0.830682 0.310201 Na\n0.847169 0.169318 0.810201 Na\n0.830682 0.677851 0.810201 Na\n0.677851 0.847169 0.310201 Na\n0.157637 0.338508 0.860654 Na\n0.819129 0.157637 0.360654 Na\n0.338508 0.180871 0.360654 Na\n0.661492 0.819129 0.860654 Na\n0.180871 0.842363 0.860654 Na\n0.842363 0.661492 0.360654 Na\n0.333333 0.666667 0.365145 Na\n0.666667 0.333333 0.865145 Na\n0.333333 0.666667 0.805111 Na\n0.666667 0.333333 0.305111 Na\n0.161919 0.172519 0.006886 Zn\n0.989399 0.161919 0.506886 Zn\n0.172519 0.010601 0.506886 Zn\n0.827481 0.989399 0.006886 Zn\n0.010601 0.838081 0.006886 Zn\n0.838081 0.827481 0.506886 Zn\n0.004240 0.335801 0.168143 Zn\n0.668438 0.004240 0.668143 Zn\n0.335801 0.331562 0.668143 Zn\n0.664199 0.668438 0.168143 Zn\n0.331562 0.995760 0.168143 Zn\n0.995760 0.664199 0.668143 Zn\n0.508486 0.339275 0.159908 Zn\n0.169211 0.508486 0.659908 Zn\n0.339275 0.830789 0.659908 Zn\n0.660725 0.169211 0.159908 Zn\n0.830789 0.491514 0.159908 Zn\n0.491514 0.660725 0.659908 Zn\n0.329400 0.495502 0.160535 Zn\n0.833897 0.329400 0.660535 Zn\n0.495502 0.166103 0.660535 Zn\n0.504498 0.833897 0.160535 Zn\n0.166103 0.670600 0.160535 Zn\n0.670600 0.504498 0.660535 Zn\n0.159632 0.173786 0.612634 P\n0.985846 0.159632 0.112634 P\n0.173786 0.014154 0.112634 P\n0.826214 0.985846 0.612634 P\n0.014154 0.840368 0.612634 P\n0.840368 0.826214 0.112634 P\n0.009636 0.338469 0.559471 P\n0.671168 0.009636 0.059471 P\n0.338469 0.328832 0.059471 P\n0.661531 0.671168 0.559471 P\n0.328832 0.990364 0.559471 P\n0.990364 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