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{
"id": "mp-556675",
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{
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{
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"structure_string": "K4 Sm2 P4 S14\n1.0\n3.391101 11.469174 0.000000\n-3.391101 11.469174 0.000000\n0.000000 1.110900 8.982996\nK Sm P S\n4 2 4 14\ndirect\n0.571602 0.313432 0.697717 K\n0.817673 0.554045 0.879327 K\n0.686568 0.428398 0.302283 K\n0.445955 0.182327 0.120673 K\n0.950206 0.729110 0.533391 Sm\n0.270890 0.049794 0.466609 Sm\n0.422397 0.122188 0.707253 P\n0.877812 0.577603 0.292747 P\n0.114546 0.855236 0.386994 P\n0.144764 0.885454 0.613006 P\n0.190628 0.927585 0.243302 S\n0.494270 0.077100 0.481033 S\n0.922900 0.505730 0.518967 S\n0.074688 0.306190 0.195190 S\n0.072415 0.809372 0.756698 S\n0.587710 0.783030 0.230671 S\n0.947307 0.184174 0.616364 S\n0.216970 0.412290 0.769329 S\n0.317632 0.050415 0.769403 S\n0.815826 0.052693 0.383636 S\n0.301455 0.561340 0.388261 S\n0.949585 0.682368 0.230597 S\n0.438660 0.698545 0.611739 S\n0.693810 0.925312 0.804810 S\n",
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{
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"created_at": "2022-09-04T14:39:46.548122Z",
"structure_string": "Li6 Zn6 P6 O24\n1.0\n5.050778 -6.937906 0.000000\n5.050778 6.937906 0.000000\n-4.479346 0.000000 7.319860\nLi Zn P O\n6 6 6 24\ndirect\n0.387909 0.789544 0.570708 Li\n0.873063 0.106071 0.278156 Li\n0.106071 0.278156 0.873063 Li\n0.278156 0.873063 0.106071 Li\n0.789544 0.570708 0.387909 Li\n0.570708 0.387909 0.789544 Li\n0.947011 0.544607 0.763722 Zn\n0.544607 0.763722 0.947011 Zn\n0.763722 0.947011 0.544607 Zn\n0.057503 0.462644 0.230436 Zn\n0.462644 0.230436 0.057503 Zn\n0.230436 0.057503 0.462644 Zn\n0.905832 0.717969 0.124191 P\n0.717969 0.124191 0.905832 P\n0.124191 0.905832 0.717969 P\n0.208559 0.431471 0.614596 P\n0.431471 0.614596 0.208559 P\n0.614596 0.208559 0.431471 P\n0.311445 0.632050 0.310880 O\n0.691092 0.353277 0.631650 O\n0.631650 0.691092 0.353277 O\n0.923591 0.256120 0.979799 O\n0.256120 0.979799 0.923591 O\n0.979799 0.923591 0.256120 O\n0.698569 0.023440 0.027286 O\n0.023440 0.027286 0.698569 O\n0.027286 0.698569 0.023440 O\n0.353277 0.631650 0.691092 O\n0.310880 0.311445 0.632050 O\n0.632050 0.310880 0.311445 O\n0.410695 0.075264 0.359621 O\n0.359621 0.410695 0.075264 O\n0.075264 0.359621 0.410695 O\n0.643345 0.980012 0.706764 O\n0.706764 0.643345 0.980012 O\n0.980012 0.706764 0.643345 O\n0.235350 0.914427 0.605299 O\n0.605299 0.235350 0.914427 O\n0.914427 0.605299 0.235350 O\n0.729008 0.099750 0.418400 O\n0.418400 0.729008 0.099750 O\n0.099750 0.418400 0.729008 O\n",
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"formula_full": "Li6 Zn6 P6 O24",
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{
"id": "mp-1518075",
"created_at": "2022-09-04T14:39:46.567211Z",
"structure_string": "Na1 Pr1 Ti4 O12\n1.0\n5.453735 0.000000 0.000000\n0.000000 5.453735 0.000000\n0.000000 0.000000 7.894207\nNa Pr Ti O\n1 1 4 12\ndirect\n0.500000 0.500000 0.000000 Na\n0.000000 0.000000 0.500000 Pr\n0.000000 0.500000 0.762654 Ti\n0.000000 0.500000 0.237346 Ti\n0.500000 0.000000 0.762654 Ti\n0.500000 0.000000 0.237346 Ti\n0.243861 0.243861 0.733809 O\n0.243861 0.243861 0.266191 O\n0.756139 0.756139 0.733809 O\n0.756139 0.756139 0.266191 O\n0.756139 0.243861 0.733809 O\n0.756139 0.243861 0.266191 O\n0.243861 0.756139 0.733809 O\n0.243861 0.756139 0.266191 O\n0.000000 0.500000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n",
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],
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"volume": 234.79917855174435,
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"formula_full": "Na1 Pr1 Ti4 O12",
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{
"id": "mp-1097997",
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"structure_string": "K6 Eu6 Ge12 O36\n1.0\n-4.311911 -5.543838 0.985731\n-4.311911 5.543838 0.985731\n0.002066 0.000000 -19.620142\nK Eu Ge O\n6 6 12 36\ndirect\n0.714187 0.924568 0.424922 K\n0.075432 0.285813 0.075078 K\n0.285813 0.075432 0.575078 K\n0.924568 0.714187 0.924922 K\n0.393730 0.606270 0.250000 K\n0.606270 0.393730 0.750000 K\n0.856162 0.143838 0.250000 Eu\n0.143838 0.856162 0.750000 Eu\n0.116259 0.530670 0.418643 Eu\n0.469330 0.883741 0.081357 Eu\n0.883741 0.469330 0.581357 Eu\n0.530670 0.116259 0.918643 Eu\n0.898530 0.634760 0.241609 Ge\n0.365240 0.101470 0.258391 Ge\n0.101470 0.365240 0.758391 Ge\n0.634760 0.898530 0.741609 Ge\n0.563319 0.386456 0.405214 Ge\n0.613544 0.436681 0.094786 Ge\n0.436681 0.613544 0.594786 Ge\n0.386456 0.563319 0.905214 Ge\n0.962827 0.802672 0.108164 Ge\n0.197328 0.037173 0.391836 Ge\n0.037173 0.197328 0.891836 Ge\n0.802672 0.962827 0.608164 Ge\n0.794799 0.818430 0.275699 O\n0.181570 0.205201 0.224301 O\n0.205201 0.181570 0.724301 O\n0.818430 0.794799 0.775699 O\n0.998289 0.501635 0.299481 O\n0.498365 0.001711 0.200519 O\n0.001711 0.498365 0.700519 O\n0.501635 0.998289 0.799481 O\n0.066882 0.721282 0.184652 O\n0.278718 0.933118 0.315348 O\n0.933118 0.278718 0.815348 O\n0.721282 0.066882 0.684652 O\n0.729785 0.420483 0.181988 O\n0.579517 0.270215 0.318012 O\n0.270215 0.579517 0.818012 O\n0.420483 0.729785 0.681988 O\n0.435092 0.567241 0.396107 O\n0.432759 0.564908 0.103893 O\n0.564908 0.432759 0.603893 O\n0.567241 0.435092 0.896107 O\n0.799776 0.463218 0.456130 O\n0.536782 0.200224 0.043870 O\n0.200224 0.536782 0.543870 O\n0.463218 0.799776 0.956130 O\n0.423382 0.195405 0.443625 O\n0.804595 0.576618 0.056375 O\n0.576618 0.804595 0.556375 O\n0.195405 0.423382 0.943625 O\n0.142999 0.889263 0.061102 O\n0.110737 0.857001 0.438898 O\n0.857001 0.110737 0.938898 O\n0.889263 0.142999 0.561102 O\n0.814978 0.965666 0.128256 O\n0.034334 0.185022 0.371744 O\n0.185022 0.034334 0.871744 O\n0.965666 0.814978 0.628256 O\n",
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{
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{
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