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{
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"structure_string": "Mn4 Bi6 O14\n1.0\n-0.000233 -0.000387 -5.807919\n-5.867097 0.000198 0.000008\n2.933157 10.305748 0.000477\nMn Bi O\n4 6 14\ndirect\n0.511627 0.627464 0.785633 Mn\n0.511438 0.841840 0.214346 Mn\n0.003247 0.378774 0.208045 Mn\n0.003114 0.170486 0.791673 Mn\n0.416812 0.127392 0.000076 Bi\n0.913279 0.833692 0.000081 Bi\n0.038893 0.969732 0.373352 Bi\n0.039064 0.596322 0.626672 Bi\n0.533545 0.052285 0.629456 Bi\n0.533400 0.423010 0.370587 Bi\n0.535156 0.753286 0.000000 O\n0.033406 0.208261 0.999987 O\n0.427053 0.079664 0.436098 O\n0.427009 0.643494 0.563948 O\n0.935711 0.950983 0.575911 O\n0.935673 0.375181 0.424106 O\n0.276880 0.632184 0.255331 O\n0.277115 0.376793 0.744687 O\n0.752560 0.395322 0.738889 O\n0.752298 0.656700 0.261163 O\n0.279414 0.073356 0.186054 O\n0.279601 0.887251 0.813958 O\n0.761925 0.880257 0.814216 O\n0.761779 0.066270 0.185731 O\n",
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{
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},
{
"id": "mp-770191",
"created_at": "2022-09-04T14:46:56.834393Z",
"structure_string": "Li8 V8 S12 O48\n1.0\n8.788535 0.000000 0.000000\n0.000000 8.982581 0.000000\n0.000000 0.000000 12.461260\nLi V S O\n8 8 12 48\ndirect\n0.216374 0.277249 0.182269 Li\n0.783626 0.777249 0.182269 Li\n0.283626 0.777249 0.317731 Li\n0.716374 0.277249 0.317731 Li\n0.283626 0.722751 0.682269 Li\n0.716374 0.222751 0.682269 Li\n0.216374 0.222751 0.817731 Li\n0.783626 0.722751 0.817731 Li\n0.252464 0.962360 0.113728 V\n0.747536 0.462360 0.113728 V\n0.752464 0.962360 0.386272 V\n0.247536 0.462360 0.386272 V\n0.247536 0.037640 0.613728 V\n0.752464 0.537640 0.613728 V\n0.252464 0.537640 0.886272 V\n0.747536 0.037640 0.886272 V\n0.455029 0.250000 0.000000 S\n0.544971 0.750000 0.000000 S\n0.102415 0.605696 0.146753 S\n0.897585 0.105696 0.146753 S\n0.397585 0.105696 0.353247 S\n0.602415 0.605696 0.353247 S\n0.044971 0.750000 0.500000 S\n0.955029 0.250000 0.500000 S\n0.397585 0.394304 0.646753 S\n0.602415 0.894304 0.646753 S\n0.102415 0.894304 0.853247 S\n0.897585 0.394304 0.853247 S\n0.136630 0.574933 0.034330 O\n0.863370 0.074933 0.034330 O\n0.545095 0.361348 0.057261 O\n0.454905 0.861348 0.057261 O\n0.352817 0.175683 0.080603 O\n0.647183 0.675683 0.080603 O\n0.066162 0.113330 0.162742 O\n0.933838 0.613330 0.162742 O\n0.168651 0.751079 0.181791 O\n0.831349 0.251079 0.181791 O\n0.834421 0.984495 0.216178 O\n0.165579 0.484495 0.216178 O\n0.334421 0.984495 0.283822 O\n0.665579 0.484495 0.283822 O\n0.668651 0.751079 0.318209 O\n0.331349 0.251079 0.318209 O\n0.433838 0.613330 0.337258 O\n0.566162 0.113330 0.337258 O\n0.147183 0.675683 0.419397 O\n0.852817 0.175683 0.419397 O\n0.045095 0.361348 0.442739 O\n0.954905 0.861348 0.442739 O\n0.636630 0.574933 0.465670 O\n0.363370 0.074933 0.465670 O\n0.363370 0.425067 0.534330 O\n0.636630 0.925067 0.534330 O\n0.045095 0.138652 0.557261 O\n0.954905 0.638652 0.557261 O\n0.147183 0.824317 0.580603 O\n0.852817 0.324317 0.580603 O\n0.433838 0.886670 0.662742 O\n0.566162 0.386670 0.662742 O\n0.331349 0.248921 0.681791 O\n0.668651 0.748921 0.681791 O\n0.334421 0.515505 0.716178 O\n0.665579 0.015505 0.716178 O\n0.165579 0.015505 0.783822 O\n0.834421 0.515505 0.783822 O\n0.168651 0.748921 0.818209 O\n0.831349 0.248921 0.818209 O\n0.066162 0.386670 0.837258 O\n0.933838 0.886670 0.837258 O\n0.352817 0.324317 0.919397 O\n0.647183 0.824317 0.919397 O\n0.454905 0.638652 0.942739 O\n0.545095 0.138652 0.942739 O\n0.136630 0.925067 0.965670 O\n0.863370 0.425067 0.965670 O\n",
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"formula_full": "Li8 V8 S12 O48",
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{
"id": "mp-540079",
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"structure_string": "Ni4 P16 O48\n1.0\n12.934409 0.000000 0.000000\n0.000000 8.331779 0.000000\n0.000000 0.000000 9.199190\nNi P O\n4 16 48\ndirect\n0.000000 0.364371 0.750000 Ni\n0.500000 0.864371 0.750000 Ni\n0.000000 0.635629 0.250000 Ni\n0.500000 0.135629 0.250000 Ni\n0.142828 0.815453 0.006616 P\n0.851428 0.458973 0.489940 P\n0.351428 0.958973 0.010060 P\n0.648572 0.958973 0.489940 P\n0.642828 0.315453 0.493384 P\n0.148572 0.541027 0.510060 P\n0.148572 0.458973 0.010060 P\n0.351428 0.041027 0.510060 P\n0.642828 0.684547 0.993384 P\n0.648572 0.041027 0.989940 P\n0.857172 0.815453 0.493384 P\n0.357172 0.684547 0.506616 P\n0.142828 0.184547 0.506616 P\n0.857172 0.184547 0.993384 P\n0.357172 0.315453 0.006616 P\n0.851428 0.541027 0.989940 P\n0.567978 0.962334 0.372554 O\n0.058839 0.809133 0.120615 O\n0.371098 0.861739 0.874386 O\n0.318380 0.138971 0.962683 O\n0.318380 0.861029 0.462683 O\n0.744889 0.392294 0.420497 O\n0.871098 0.361739 0.625614 O\n0.932022 0.537666 0.872554 O\n0.371098 0.138261 0.374387 O\n0.891411 0.908232 0.625980 O\n0.818380 0.361029 0.037317 O\n0.058839 0.190867 0.620615 O\n0.628902 0.861739 0.625614 O\n0.255111 0.607706 0.579503 O\n0.244889 0.892294 0.079503 O\n0.391411 0.591768 0.374020 O\n0.128902 0.361739 0.874386 O\n0.441161 0.690867 0.620615 O\n0.244889 0.107706 0.579503 O\n0.755111 0.892294 0.420497 O\n0.432022 0.037666 0.627446 O\n0.681620 0.861029 0.037317 O\n0.941161 0.190867 0.879385 O\n0.181620 0.638971 0.962683 O\n0.818380 0.638971 0.537317 O\n0.181620 0.361029 0.462683 O\n0.891411 0.091768 0.125980 O\n0.871098 0.638261 0.125613 O\n0.441161 0.309133 0.120615 O\n0.941161 0.809133 0.379385 O\n0.391411 0.408232 0.874020 O\n0.567978 0.037666 0.872554 O\n0.608589 0.408232 0.625980 O\n0.558839 0.690867 0.879385 O\n0.558839 0.309133 0.379385 O\n0.067978 0.462334 0.127446 O\n0.932022 0.462334 0.372554 O\n0.681620 0.138971 0.537317 O\n0.108589 0.091768 0.374020 O\n0.608589 0.591768 0.125980 O\n0.755111 0.107706 0.920497 O\n0.432022 0.962334 0.127446 O\n0.128902 0.638261 0.374387 O\n0.255111 0.392294 0.079503 O\n0.744889 0.607706 0.920497 O\n0.108589 0.908232 0.874020 O\n0.628902 0.138261 0.125613 O\n0.067978 0.537666 0.627446 O\n",
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{
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"structure_string": "Sm4 In21 Pd10\n1.0\n2.253593 11.642381 0.000000\n-2.253593 11.642381 0.000000\n0.000000 9.697765 14.569981\nSm In Pd\n4 21 10\ndirect\n0.230257 0.230257 0.672331 Sm\n0.769743 0.769743 0.327669 Sm\n0.878135 0.878135 0.832152 Sm\n0.121865 0.121865 0.167848 Sm\n0.500000 0.500000 0.000000 In\n0.115460 0.115460 0.949364 In\n0.884540 0.884540 0.050636 In\n0.457611 0.457611 0.867145 In\n0.542389 0.542389 0.132855 In\n0.063636 0.063636 0.703149 In\n0.936364 0.936364 0.296851 In\n0.367978 0.367978 0.700002 In\n0.632022 0.632022 0.299998 In\n0.988332 0.988332 0.594091 In\n0.011668 0.011668 0.405909 In\n0.748818 0.748818 0.794071 In\n0.251182 0.251182 0.205929 In\n0.616354 0.616354 0.795269 In\n0.383646 0.383646 0.204731 In\n0.601259 0.601259 0.504297 In\n0.398741 0.398741 0.495703 In\n0.202410 0.202410 0.495341 In\n0.797590 0.797590 0.504659 In\n0.700625 0.700625 0.999955 In\n0.299375 0.299375 0.000045 In\n0.250900 0.250900 0.884939 Pd\n0.749100 0.749100 0.115061 Pd\n0.025284 0.025284 0.887930 Pd\n0.974716 0.974716 0.112070 Pd\n0.653455 0.653455 0.614845 Pd\n0.346545 0.346545 0.385155 Pd\n0.860685 0.860685 0.607378 Pd\n0.139315 0.139315 0.392622 Pd\n0.493430 0.493430 0.687646 Pd\n0.506570 0.506570 0.312354 Pd\n",
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{
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"structure_string": "Li3 Fe5 Co2 O12\n1.0\n4.483323 2.526126 0.000000\n-4.483323 2.526126 0.000000\n0.000000 1.827830 9.662868\nLi Fe Co O\n3 5 2 12\ndirect\n0.672830 0.850198 0.741411 Li\n0.149802 0.327170 0.258589 Li\n0.079417 0.920583 0.500000 Li\n0.921214 0.078786 0.000000 Fe\n0.013083 0.525541 0.734531 Fe\n0.474459 0.986917 0.265469 Fe\n0.583973 0.416027 0.000000 Fe\n0.432124 0.567876 0.500000 Fe\n0.745516 0.254484 0.500000 Co\n0.248456 0.751544 0.000000 Co\n0.879061 0.369672 0.111952 O\n0.630328 0.120939 0.888048 O\n0.726887 0.546683 0.618832 O\n0.961259 0.774118 0.887097 O\n0.453317 0.273113 0.381168 O\n0.766201 0.967501 0.376609 O\n0.520362 0.718853 0.111341 O\n0.225882 0.038741 0.112903 O\n0.392101 0.860322 0.617281 O\n0.032499 0.233799 0.623391 O\n0.281147 0.479638 0.888659 O\n0.139678 0.607899 0.382719 O\n",
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{
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"structure_string": "Rb6 Co6 Br18\n1.0\n6.527763 -11.306417 0.000000\n6.527763 11.306417 0.000000\n0.000000 0.000000 6.230356\nRb Co Br\n6 6 18\ndirect\n0.665906 0.000000 0.204598 Rb\n0.000000 0.665906 0.204598 Rb\n0.334094 0.000000 0.704598 Rb\n0.000000 0.334094 0.704598 Rb\n0.334094 0.334094 0.204598 Rb\n0.665906 0.665906 0.704598 Rb\n0.000000 0.000000 0.987371 Co\n0.000000 0.000000 0.487371 Co\n0.333333 0.666667 0.433843 Co\n0.666667 0.333333 0.933843 Co\n0.333333 0.666667 0.933843 Co\n0.666667 0.333333 0.433843 Co\n0.175991 0.508753 0.183412 Br\n0.491247 0.667238 0.183412 Br\n0.824009 0.491247 0.683412 Br\n0.491247 0.824009 0.683412 Br\n0.332762 0.824009 0.183412 Br\n0.508753 0.332762 0.683412 Br\n0.332762 0.508753 0.683412 Br\n0.508753 0.175991 0.183412 Br\n0.667238 0.175991 0.683412 Br\n0.667238 0.491247 0.183412 Br\n0.175991 0.667238 0.683412 Br\n0.824009 0.332762 0.183412 Br\n0.157492 0.000000 0.239126 Br\n0.000000 0.157492 0.239126 Br\n0.842508 0.000000 0.739126 Br\n0.000000 0.842508 0.739126 Br\n0.842508 0.842508 0.239126 Br\n0.157492 0.157492 0.739126 Br\n",
"nsites": 30,
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{
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