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{
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{
"id": "mp-720971",
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"formula_full": "Ca12 Al11 Si3 Cl5 O32",
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"updated_at": "2021-11-28T01:37:41.942000Z",
"spacegroup": 1
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{
"id": "mp-1218843",
"created_at": "2022-09-04T14:45:11.627787Z",
"structure_string": "Sr12 V20 S44\n1.0\n7.504334 4.313419 0.000000\n-7.504334 4.313419 0.000000\n0.000000 3.467210 23.251517\nSr V S\n12 20 44\ndirect\n0.807198 0.857181 0.178532 Sr\n0.142819 0.192802 0.321468 Sr\n0.192802 0.142819 0.821468 Sr\n0.857181 0.807198 0.678532 Sr\n0.611554 0.259005 0.176015 Sr\n0.740995 0.388446 0.323985 Sr\n0.388446 0.740995 0.823985 Sr\n0.259005 0.611554 0.676015 Sr\n0.202230 0.453077 0.178831 Sr\n0.546923 0.797770 0.321169 Sr\n0.797770 0.546923 0.821169 Sr\n0.453077 0.202230 0.678831 Sr\n0.235786 0.880162 0.124296 V\n0.119838 0.764214 0.375704 V\n0.764214 0.119838 0.875704 V\n0.880162 0.235786 0.624296 V\n0.175889 0.824111 0.250000 V\n0.824111 0.175889 0.750000 V\n0.847180 0.760408 0.997609 V\n0.239592 0.152820 0.502391 V\n0.152820 0.239592 0.002391 V\n0.760408 0.847180 0.497609 V\n0.000000 0.500000 0.000000 V\n0.500000 0.000000 0.500000 V\n0.547293 0.371131 0.999806 V\n0.628869 0.452707 0.500194 V\n0.452707 0.628869 0.000194 V\n0.371131 0.547293 0.499806 V\n0.259762 0.935533 0.996562 V\n0.064467 0.740238 0.503438 V\n0.740238 0.064467 0.003438 V\n0.935533 0.259762 0.496562 V\n0.356330 0.202248 0.935125 S\n0.797752 0.643670 0.564875 S\n0.643670 0.797752 0.064875 S\n0.202248 0.356330 0.435125 S\n0.058293 0.949784 0.060045 S\n0.050216 0.941707 0.439955 S\n0.941707 0.050216 0.939955 S\n0.949784 0.058293 0.560045 S\n0.981019 0.631992 0.184460 S\n0.368008 0.018981 0.315540 S\n0.018981 0.368008 0.815540 S\n0.631992 0.981019 0.684460 S\n0.207680 0.075035 0.186366 S\n0.924965 0.792320 0.313634 S\n0.792320 0.924965 0.813634 S\n0.075035 0.207680 0.686366 S\n0.780491 0.517315 0.061661 S\n0.482685 0.219509 0.438339 S\n0.219509 0.482685 0.938339 S\n0.517315 0.780491 0.561661 S\n0.497975 0.098521 0.055770 S\n0.901479 0.502025 0.444230 S\n0.502025 0.901479 0.944230 S\n0.098521 0.497975 0.555770 S\n0.069701 0.759955 0.931781 S\n0.240045 0.930299 0.568219 S\n0.930299 0.240045 0.068219 S\n0.759955 0.069701 0.431781 S\n0.841715 0.158285 0.250000 S\n0.158285 0.841715 0.750000 S\n0.351519 0.380596 0.068547 S\n0.619404 0.648481 0.431453 S\n0.648481 0.619404 0.931453 S\n0.380596 0.351519 0.568547 S\n0.775560 0.325539 0.942839 S\n0.674461 0.224440 0.557161 S\n0.224440 0.674461 0.057161 S\n0.325539 0.775560 0.442839 S\n0.426588 0.849839 0.186184 S\n0.150161 0.573412 0.313816 S\n0.573412 0.150161 0.813816 S\n0.849839 0.426588 0.686184 S\n0.509746 0.490254 0.250000 S\n0.490254 0.509746 0.750000 S\n",
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"formula_full": "Sr12 V20 S44",
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"updated_at": "2021-11-28T01:36:51.712000Z",
"spacegroup": 15
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{
"id": "mp-1100378",
"created_at": "2022-09-04T14:48:27.499293Z",
"structure_string": "Ca10 Sn6 S22\n1.0\n8.749305 0.000000 0.000000\n1.992931 8.519944 0.000000\n1.179033 1.161221 13.816520\nCa Sn S\n10 6 22\ndirect\n0.041170 0.015535 0.241758 Ca\n0.958830 0.984465 0.758242 Ca\n0.900229 0.549444 0.233207 Ca\n0.099771 0.450556 0.766793 Ca\n0.447317 0.078272 0.754187 Ca\n0.552683 0.921728 0.245813 Ca\n0.300189 0.708463 0.997424 Ca\n0.699811 0.291537 0.002576 Ca\n0.666289 0.327741 0.493667 Ca\n0.333711 0.672259 0.506333 Ca\n0.429030 0.453439 0.257741 Sn\n0.570970 0.546561 0.742259 Sn\n0.175922 0.185982 0.467324 Sn\n0.824078 0.814018 0.532676 Sn\n0.215942 0.210006 0.017463 Sn\n0.784058 0.789994 0.982537 Sn\n0.586389 0.599335 0.331984 S\n0.413611 0.400665 0.668016 S\n0.316600 0.964625 0.109820 S\n0.683400 0.035375 0.890180 S\n0.969564 0.295132 0.109236 S\n0.030436 0.704868 0.890764 S\n0.289980 0.950541 0.387224 S\n0.710020 0.049459 0.612776 S\n0.943925 0.284668 0.379691 S\n0.056075 0.715332 0.620309 S\n0.153326 0.138208 0.863133 S\n0.846674 0.861792 0.136867 S\n0.351659 0.372449 0.430691 S\n0.648341 0.627551 0.569309 S\n0.844243 0.838912 0.361366 S\n0.155757 0.161088 0.638634 S\n0.622078 0.611490 0.043778 S\n0.377922 0.388510 0.956222 S\n0.200219 0.617674 0.193874 S\n0.799781 0.382326 0.806126 S\n0.600388 0.225291 0.201304 S\n0.399612 0.774709 0.798696 S\n",
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"volume": 1029.932983301411,
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"formula_full": "Ca10 Sn6 S22",
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{
"id": "mp-1218480",
"created_at": "2022-09-04T14:43:41.526457Z",
"structure_string": "Sr5 Ir3 O11\n1.0\n2.833012 2.787410 0.000000\n-2.833012 2.787410 0.000000\n0.000000 0.084997 16.770108\nSr Ir O\n5 3 11\ndirect\n0.019211 0.015047 0.730028 Sr\n0.984953 0.980789 0.269972 Sr\n0.517041 0.489635 0.889303 Sr\n0.510365 0.482959 0.110697 Sr\n0.999835 0.000165 0.500000 Sr\n0.008085 0.991915 0.000000 Ir\n0.505033 0.504623 0.622866 Ir\n0.495377 0.494967 0.377134 Ir\n0.500091 0.499909 0.500000 O\n0.007701 0.996107 0.875863 O\n0.003893 0.992299 0.124137 O\n0.504715 0.503069 0.744027 O\n0.496931 0.495285 0.255973 O\n0.031904 0.490073 0.000036 O\n0.509927 0.968096 0.999964 O\n0.010064 0.557501 0.620588 O\n0.557505 0.009830 0.620683 O\n0.990170 0.442495 0.379317 O\n0.442499 0.989936 0.379412 O\n",
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"formula_full": "Sr5 Ir3 O11",
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{
"id": "mp-557340",
"created_at": "2022-09-04T14:44:25.878316Z",
"structure_string": "Ge9 Pb15 O33\n1.0\n5.217835 -9.037556 0.000000\n5.217835 9.037556 0.000000\n0.000000 0.000000 10.899195\nGe Pb O\n9 15 33\ndirect\n0.605398 0.626054 0.147497 Ge\n0.020656 0.394602 0.147497 Ge\n0.616766 0.007678 0.504708 Ge\n0.373946 0.979344 0.147497 Ge\n0.390913 0.383234 0.504708 Ge\n0.611661 0.619861 0.845007 Ge\n0.008200 0.388339 0.845007 Ge\n0.992322 0.609087 0.504708 Ge\n0.380139 0.991800 0.845007 Ge\n0.737693 0.739715 0.521668 Pb\n0.740331 0.003386 0.816395 Pb\n0.666667 0.333333 0.320905 Pb\n0.002782 0.728635 0.184998 Pb\n0.271365 0.274147 0.184998 Pb\n0.263055 0.259669 0.816395 Pb\n0.260285 0.997978 0.521668 Pb\n0.333333 0.666667 0.001660 Pb\n0.333333 0.666667 0.663440 Pb\n0.002022 0.262307 0.521668 Pb\n0.333333 0.666667 0.340504 Pb\n0.666667 0.333333 0.000310 Pb\n0.996614 0.736945 0.816395 Pb\n0.725853 0.997218 0.184998 Pb\n0.666667 0.333333 0.674580 Pb\n0.830107 0.325006 0.161516 O\n0.234053 0.915932 0.736228 O\n0.189277 0.704681 0.503355 O\n0.084068 0.318121 0.736228 O\n0.678801 0.769744 0.256393 O\n0.515404 0.810723 0.503355 O\n0.123903 0.593629 0.153492 O\n0.674994 0.505101 0.161516 O\n0.928191 0.689562 0.616767 O\n0.090942 0.321199 0.256393 O\n0.709173 0.523096 0.836687 O\n0.813922 0.290827 0.836687 O\n0.469727 0.876097 0.153492 O\n0.582820 0.494723 0.537482 O\n0.416092 0.510796 0.830495 O\n0.489204 0.905296 0.830495 O\n0.714118 0.087940 0.367045 O\n0.295319 0.484596 0.503355 O\n0.287259 0.931228 0.994467 O\n0.094704 0.583908 0.830495 O\n0.373823 0.285882 0.367045 O\n0.505277 0.088097 0.537482 O\n0.310438 0.238629 0.616767 O\n0.068772 0.356031 0.994467 O\n0.476904 0.186078 0.836687 O\n0.911903 0.417180 0.537482 O\n0.230256 0.909058 0.256393 O\n0.643969 0.712741 0.994467 O\n0.406371 0.530273 0.153492 O\n0.494899 0.169893 0.161516 O\n0.761371 0.071809 0.616767 O\n0.681879 0.765947 0.736228 O\n0.912060 0.626177 0.367045 O\n",
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"formula_full": "Ge9 Pb15 O33",
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{
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"created_at": "2022-09-04T14:41:26.152244Z",
"structure_string": "Hg10 N6 O22\n1.0\n-0.151590 -0.083303 -8.194320\n3.300839 -8.541168 0.658832\n-9.986575 -0.030781 1.891718\nHg N O\n10 6 22\ndirect\n0.654899 0.763697 0.258031 Hg\n0.345101 0.236303 0.741969 Hg\n0.719962 0.056232 0.287469 Hg\n0.280038 0.943768 0.712531 Hg\n0.602444 0.432159 0.418656 Hg\n0.397556 0.567841 0.581344 Hg\n0.731879 0.362694 0.094315 Hg\n0.268121 0.637306 0.905685 Hg\n0.836737 0.154005 0.890036 Hg\n0.163263 0.845995 0.109964 Hg\n0.276518 0.204248 0.068283 N\n0.723482 0.795752 0.931717 N\n0.909228 0.366602 0.686351 N\n0.090772 0.633398 0.313649 N\n0.200086 0.123342 0.391824 N\n0.799914 0.876659 0.608176 N\n0.767232 0.291261 0.300709 O\n0.232768 0.708739 0.699291 O\n0.584030 0.523498 0.214377 O\n0.415970 0.476502 0.785623 O\n0.158707 0.093441 0.995058 O\n0.841293 0.906559 0.004942 O\n0.403425 0.175194 0.138370 O\n0.596575 0.824806 0.861630 O\n0.263383 0.339191 0.065693 O\n0.736617 0.660809 0.934307 O\n0.920836 0.477496 0.641402 O\n0.079164 0.522504 0.358598 O\n0.022444 0.363201 0.788230 O\n0.977556 0.636799 0.211770 O\n0.787791 0.259022 0.633853 O\n0.212209 0.740978 0.366147 O\n0.083223 0.044934 0.279366 O\n0.916777 0.955066 0.720634 O\n0.345169 0.089168 0.399281 O\n0.654831 0.910832 0.600719 O\n0.156459 0.230875 0.488114 O\n0.843541 0.769125 0.511886 O\n",
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{
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