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{
"id": "mp-686585",
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"structure_string": "K6 Al11 Si13 Ag5 O48\n1.0\n12.602110 0.000000 0.000000\n0.000000 12.397170 0.000000\n0.000000 0.075693 12.694085\nK Al Si Ag O\n6 11 13 5 48\ndirect\n0.607813 0.001195 0.460013 K\n0.392187 0.001195 0.460013 K\n0.772982 0.239295 0.239891 K\n0.772312 0.761633 0.239616 K\n0.227688 0.761633 0.239616 K\n0.227018 0.239295 0.239891 K\n0.819963 0.999052 0.636297 Al\n0.180037 0.999052 0.636297 Al\n0.000000 0.190065 0.633634 Al\n0.823163 0.998011 0.372386 Al\n0.000000 0.805827 0.377749 Al\n0.176837 0.998011 0.372386 Al\n0.000000 0.191393 0.374253 Al\n0.626536 0.999839 0.182140 Al\n0.373464 0.999839 0.182140 Al\n0.000000 0.630273 0.174576 Al\n0.000000 0.370780 0.172210 Al\n0.624694 0.812881 0.996793 Si\n0.812847 0.373791 0.994032 Si\n0.375306 0.812881 0.996793 Si\n0.186174 0.628865 0.994335 Si\n0.625144 0.186625 0.994547 Si\n0.187153 0.373791 0.994032 Si\n0.373726 0.999666 0.819591 Si\n0.626274 0.999666 0.819591 Si\n0.000000 0.375314 0.822100 Si\n0.000000 0.630321 0.821846 Si\n0.000000 0.811192 0.635484 Si\n0.813826 0.628865 0.994335 Si\n0.374856 0.186625 0.994547 Si\n0.189076 0.195706 0.804618 Ag\n0.810924 0.195706 0.804618 Ag\n0.196608 0.810203 0.805780 Ag\n0.803392 0.810203 0.805780 Ag\n0.000000 0.001437 0.225969 Ag\n0.706159 0.707674 0.985382 O\n0.774111 0.501805 0.987385 O\n0.500000 0.770892 0.988254 O\n0.706225 0.292900 0.983736 O\n0.293841 0.707674 0.985382 O\n0.293775 0.292900 0.983736 O\n0.888488 0.657177 0.887411 O\n0.650896 0.889127 0.890932 O\n0.650967 0.110127 0.889071 O\n0.111512 0.657177 0.887411 O\n0.888517 0.350459 0.889113 O\n0.349104 0.889127 0.890932 O\n0.349033 0.110127 0.889071 O\n0.111483 0.350459 0.889113 O\n0.500000 0.999972 0.788712 O\n0.000000 0.503683 0.795043 O\n0.699157 0.993666 0.716253 O\n0.000000 0.302160 0.721064 O\n0.300843 0.993666 0.716253 O\n0.000000 0.704098 0.717186 O\n0.892469 0.878745 0.670103 O\n0.886878 0.114435 0.675249 O\n0.107531 0.878745 0.670103 O\n0.113122 0.114435 0.675249 O\n0.786146 0.996271 0.505736 O\n0.000000 0.226161 0.504904 O\n0.213854 0.996271 0.505736 O\n0.000000 0.775563 0.515240 O\n0.888581 0.880623 0.342068 O\n0.889247 0.113507 0.336154 O\n0.111419 0.880623 0.342068 O\n0.110753 0.113507 0.336154 O\n0.000000 0.289477 0.278605 O\n0.707925 0.998039 0.291758 O\n0.292075 0.998039 0.291758 O\n0.000000 0.705483 0.285525 O\n0.500000 0.999777 0.234664 O\n0.000000 0.499994 0.207636 O\n0.881545 0.658806 0.095769 O\n0.648259 0.881582 0.100962 O\n0.648791 0.117856 0.099749 O\n0.118455 0.658806 0.095769 O\n0.879687 0.344246 0.096305 O\n0.351741 0.881582 0.100962 O\n0.351209 0.117856 0.099749 O\n0.120313 0.344246 0.096305 O\n0.500000 0.228522 0.986398 O\n0.225889 0.501805 0.987385 O\n",
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"density_atomic": 0.04185148452502869,
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"formula_full": "K6 Al11 Si13 Ag5 O48",
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{
"id": "mp-1224691",
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"structure_string": "Fe2 Sb1 Te3\n1.0\n3.743081 0.000000 0.000000\n0.000000 5.376070 0.000000\n0.000000 0.081298 6.288151\nFe Sb Te\n2 1 3\ndirect\n0.500000 0.504273 0.501461 Fe\n0.000000 0.996909 0.995657 Fe\n0.500000 0.283259 0.145653 Sb\n0.500000 0.714423 0.860992 Te\n0.000000 0.778042 0.354872 Te\n0.000000 0.223094 0.641364 Te\n",
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{
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"structure_string": "Sr4 Ca4 Fe2 Co6 O24\n1.0\n7.821434 0.000000 0.000000\n0.000000 7.590935 0.000000\n0.000000 0.000506 7.680095\nSr Ca Fe Co O\n4 4 2 6 24\ndirect\n0.500000 0.251003 0.253450 Sr\n0.000000 0.250358 0.253719 Sr\n0.000000 0.250468 0.746682 Sr\n0.500000 0.748562 0.746645 Sr\n0.500000 0.755217 0.259540 Ca\n0.000000 0.753467 0.259452 Ca\n0.500000 0.245895 0.740427 Ca\n0.000000 0.753532 0.739216 Ca\n0.249804 0.997813 0.999926 Fe\n0.750196 0.997813 0.999926 Fe\n0.249976 0.500512 0.999961 Co\n0.750024 0.500512 0.999961 Co\n0.250114 0.998768 0.500154 Co\n0.749886 0.998768 0.500154 Co\n0.249866 0.501699 0.499891 Co\n0.750134 0.501699 0.499891 Co\n0.249899 0.993382 0.247332 O\n0.750101 0.993382 0.247332 O\n0.249759 0.503979 0.265272 O\n0.750241 0.503979 0.265272 O\n0.249680 0.998204 0.752722 O\n0.750320 0.998204 0.752722 O\n0.249387 0.500409 0.734816 O\n0.750613 0.500409 0.734816 O\n0.251196 0.262948 0.998360 O\n0.748804 0.262948 0.998360 O\n0.249189 0.736991 0.001210 O\n0.750811 0.736991 0.001210 O\n0.248756 0.237170 0.501461 O\n0.751244 0.237170 0.501461 O\n0.252739 0.761888 0.498707 O\n0.747261 0.761888 0.498707 O\n0.500000 0.997463 0.000605 O\n0.000000 0.994393 0.000303 O\n0.500000 0.501882 0.000462 O\n0.000000 0.503538 0.000130 O\n0.500000 0.000405 0.499234 O\n0.000000 0.988879 0.499719 O\n0.500000 0.496621 0.500877 O\n0.000000 0.520791 0.499915 O\n",
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{
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"structure_string": "Ca3 Fe6 Sn2 O16\n1.0\n0.000000 0.000000 3.107925\n9.357454 0.038721 0.000000\n0.045776 10.957792 0.000000\nCa Fe Sn O\n3 6 2 16\ndirect\n0.250000 0.254710 0.839403 Ca\n0.250000 0.755889 0.661271 Ca\n0.750000 0.743459 0.154143 Ca\n0.250000 0.938467 0.886953 Fe\n0.250000 0.436116 0.610730 Fe\n0.750000 0.066337 0.107586 Fe\n0.750000 0.551419 0.395743 Fe\n0.750000 0.093153 0.602783 Fe\n0.750000 0.586897 0.892450 Fe\n0.250000 0.921775 0.394972 Sn\n0.250000 0.410558 0.109606 Sn\n0.250000 0.616584 0.025915 O\n0.250000 0.111426 0.486593 O\n0.750000 0.382621 0.974593 O\n0.750000 0.875383 0.524868 O\n0.250000 0.916021 0.069859 O\n0.250000 0.429855 0.433786 O\n0.750000 0.082296 0.923187 O\n0.750000 0.583999 0.580383 O\n0.250000 0.706023 0.334419 O\n0.250000 0.196610 0.138047 O\n0.750000 0.297487 0.670552 O\n0.750000 0.794763 0.836712 O\n0.250000 0.025786 0.717446 O\n0.250000 0.529096 0.787973 O\n0.750000 0.961531 0.274536 O\n0.750000 0.482739 0.215491 O\n",
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"formula_full": "Ca3 Fe6 Sn2 O16",
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{
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"created_at": "2022-09-04T14:44:59.271947Z",
"structure_string": "Ba4 Cu11 Te8 S2\n1.0\n4.356407 0.000000 0.000000\n0.000000 9.679955 0.000000\n0.000000 0.004995 14.241034\nBa Cu Te S\n4 11 8 2\ndirect\n0.500000 0.477625 0.664246 Ba\n0.500000 0.524538 0.339763 Ba\n0.500000 0.976546 0.842727 Ba\n0.500000 0.024747 0.157472 Ba\n0.500000 0.118151 0.592034 Cu\n0.500000 0.881214 0.408402 Cu\n0.500000 0.609904 0.906527 Cu\n0.500000 0.381671 0.092531 Cu\n0.000000 0.249096 0.513765 Cu\n0.000000 0.751274 0.486560 Cu\n0.000000 0.751545 0.987336 Cu\n0.000000 0.254625 0.004195 Cu\n0.000000 0.523054 0.082633 Cu\n0.000000 0.975411 0.589784 Cu\n0.000000 0.025119 0.410752 Cu\n0.000000 0.193267 0.699609 Te\n0.000000 0.807847 0.300757 Te\n0.000000 0.686433 0.808243 Te\n0.000000 0.309242 0.197087 Te\n0.500000 0.331885 0.911148 Te\n0.500000 0.675879 0.091950 Te\n0.500000 0.822469 0.593375 Te\n0.500000 0.177419 0.406352 Te\n0.000000 0.500098 0.500473 S\n0.000000 0.998353 0.002367 S\n",
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{
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{
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{
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