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{
"id": "mp-1225149",
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"structure_string": "Gd10 Si4 B2 O26\n1.0\n6.922141 0.000000 0.000000\n0.000000 9.348553 0.000000\n0.000000 4.657322 8.140870\nGd Si B O\n10 4 2 26\ndirect\n0.500000 0.985383 0.774627 Gd\n0.500000 0.241399 0.007393 Gd\n0.500000 0.751969 0.226208 Gd\n0.000000 0.977357 0.244385 Gd\n0.000000 0.759098 0.007733 Gd\n0.000000 0.245626 0.757062 Gd\n0.750596 0.353093 0.325486 Gd\n0.250884 0.664204 0.670160 Gd\n0.749116 0.664204 0.670160 Gd\n0.249404 0.353093 0.325486 Gd\n0.500000 0.402007 0.629030 Si\n0.500000 0.972615 0.397706 Si\n0.000000 0.365535 0.031240 Si\n0.000000 0.032564 0.595930 Si\n0.500000 0.629866 0.967376 B\n0.000000 0.597429 0.373914 B\n0.677707 0.739082 0.914283 O\n0.688349 0.345356 0.751011 O\n0.689203 0.906608 0.342575 O\n0.190167 0.247587 0.093113 O\n0.176826 0.650715 0.260822 O\n0.190020 0.093107 0.657481 O\n0.809833 0.247587 0.093113 O\n0.823174 0.650715 0.260822 O\n0.809980 0.093107 0.657481 O\n0.322293 0.739082 0.914283 O\n0.311651 0.345356 0.751011 O\n0.310797 0.906608 0.342575 O\n0.500000 0.520811 0.150281 O\n0.500000 0.327480 0.505463 O\n0.500000 0.172214 0.320414 O\n0.000000 0.488001 0.832426 O\n0.000000 0.667897 0.483960 O\n0.000000 0.832361 0.674746 O\n0.500000 0.535594 0.875410 O\n0.500000 0.604022 0.526953 O\n0.500000 0.870242 0.600008 O\n0.000000 0.471722 0.127460 O\n0.000000 0.411721 0.464238 O\n0.000000 0.132977 0.394447 O\n0.500000 0.001209 0.005104 O\n0.000000 0.003396 0.996625 O\n",
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{
"id": "mp-1220520",
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"structure_string": "Nd12 Rh3\n1.0\n10.026222 0.000000 0.000000\n0.000000 6.486293 0.000000\n0.000000 0.059786 7.290803\nNd Rh\n12 3\ndirect\n0.000000 0.155840 0.475154 Nd\n0.000000 0.351987 0.960708 Nd\n0.500000 0.860489 0.535150 Nd\n0.500000 0.651932 0.033479 Nd\n0.182953 0.666979 0.318760 Nd\n0.819322 0.840902 0.821721 Nd\n0.686185 0.337751 0.677759 Nd\n0.319667 0.175117 0.179067 Nd\n0.313815 0.337751 0.677759 Nd\n0.680333 0.175117 0.179067 Nd\n0.817047 0.666979 0.318760 Nd\n0.180678 0.840902 0.821721 Nd\n0.000000 0.579923 0.616228 Rh\n0.500000 0.076308 0.880198 Rh\n0.500000 0.440023 0.382469 Rh\n",
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"elements": [
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"density": 7.1431410010529985,
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{
"id": "mp-758427",
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"structure_string": "Li4 Cu6 C6 O18\n1.0\n6.241909 0.000000 0.000000\n0.000000 8.190346 0.000000\n0.000000 4.075815 7.121801\nLi Cu C O\n4 6 6 18\ndirect\n0.000000 0.675136 0.027149 Li\n0.500000 0.027943 0.296806 Li\n0.500000 0.297631 0.675093 Li\n0.000000 0.295957 0.676231 Li\n0.248076 0.978049 0.655437 Cu\n0.751924 0.978049 0.655437 Cu\n0.752556 0.664041 0.355316 Cu\n0.247444 0.664041 0.355316 Cu\n0.254394 0.361586 0.988030 Cu\n0.745606 0.361586 0.988030 Cu\n0.000000 0.662330 0.672018 C\n0.500000 0.663934 0.664480 C\n0.250018 0.001687 0.996919 C\n0.749982 0.001687 0.996919 C\n0.249995 0.333858 0.335007 C\n0.750005 0.333858 0.335007 C\n0.731576 0.934095 0.175220 O\n0.268424 0.934095 0.175220 O\n0.000000 0.843419 0.587333 O\n0.500000 0.848639 0.575620 O\n0.000000 0.573534 0.576046 O\n0.500000 0.578348 0.564543 O\n0.772294 0.892843 0.926260 O\n0.227706 0.892843 0.926260 O\n0.000000 0.563723 0.856268 O\n0.500000 0.568425 0.844557 O\n0.253531 0.185466 0.884259 O\n0.746469 0.185466 0.884259 O\n0.230811 0.512766 0.227317 O\n0.769189 0.512766 0.227317 O\n0.266293 0.223403 0.266247 O\n0.733707 0.223403 0.266247 O\n0.252636 0.262342 0.518178 O\n0.747364 0.262342 0.518178 O\n",
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"elements": [
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],
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"density": 3.507669495504004,
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"volume": 364.090641436193,
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"formula_full": "Li4 Cu6 C6 O18",
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{
"id": "mp-985595",
"created_at": "2022-09-04T14:41:09.664056Z",
"structure_string": "Zn24 H4 O24\n1.0\n6.658658 0.000262 0.002418\n0.000227 5.770604 0.003708\n0.014777 0.026128 41.603443\nZn H O\n24 4 24\ndirect\n0.001482 0.333071 0.142634 Zn\n0.501501 0.333026 0.142628 Zn\n0.251480 0.833297 0.142432 Zn\n0.751462 0.833308 0.142429 Zn\n0.251358 0.166544 0.206566 Zn\n0.751502 0.166531 0.206566 Zn\n0.001473 0.666629 0.206534 Zn\n0.501482 0.666764 0.206565 Zn\n0.001386 0.333142 0.269879 Zn\n0.501372 0.332523 0.269661 Zn\n0.250858 0.833266 0.269608 Zn\n0.751819 0.833273 0.269610 Zn\n0.250848 0.163824 0.332689 Zn\n0.750181 0.163808 0.332691 Zn\n0.000524 0.665109 0.332779 Zn\n0.500536 0.664934 0.331810 Zn\n0.000143 0.330288 0.394229 Zn\n0.500143 0.338134 0.394949 Zn\n0.253805 0.828834 0.395427 Zn\n0.746538 0.828796 0.395434 Zn\n0.254298 0.163468 0.452465 Zn\n0.745767 0.163471 0.452471 Zn\n0.000065 0.663746 0.452905 Zn\n0.500010 0.666612 0.462168 Zn\n0.251428 0.169006 0.099626 H\n0.751703 0.169004 0.099618 H\n0.001572 0.664338 0.099614 H\n0.501537 0.664369 0.099610 H\n0.251549 0.167338 0.123371 O\n0.751646 0.167333 0.123368 O\n0.001564 0.665921 0.123357 O\n0.501556 0.665924 0.123355 O\n0.001524 0.333529 0.189570 O\n0.501532 0.333536 0.189580 O\n0.251553 0.833618 0.189436 O\n0.751567 0.833620 0.189433 O\n0.251152 0.166594 0.254432 O\n0.751810 0.166589 0.254432 O\n0.501447 0.666370 0.254471 O\n0.001441 0.665868 0.254393 O\n0.000590 0.331620 0.318667 O\n0.500601 0.330352 0.318322 O\n0.249603 0.831846 0.318231 O\n0.751608 0.831847 0.318231 O\n0.251556 0.163917 0.382301 O\n0.748872 0.163898 0.382305 O\n0.000238 0.665500 0.382397 O\n0.500244 0.666299 0.380778 O\n0.000050 0.328042 0.446073 O\n0.500051 0.341144 0.446033 O\n0.253409 0.828048 0.446588 O\n0.746733 0.828045 0.446595 O\n",
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{
"id": "mp-673301",
"created_at": "2022-09-04T14:41:09.833296Z",
"structure_string": "La2 H6 O6\n1.0\n3.832232 0.000000 0.000000\n0.000000 6.616844 0.000000\n0.000000 3.264868 5.810183\nLa H O\n2 6 6\ndirect\n0.000000 0.333710 0.335627 La\n0.500000 0.660889 0.675606 La\n0.000000 0.861833 0.856971 H\n0.000000 0.857393 0.307067 H\n0.000000 0.281245 0.861725 H\n0.500000 0.133604 0.148691 H\n0.500000 0.141773 0.714931 H\n0.500000 0.720607 0.140879 H\n0.000000 0.911472 0.693093 O\n0.000000 0.690569 0.407144 O\n0.000000 0.392099 0.918337 O\n0.500000 0.088153 0.311451 O\n0.500000 0.307728 0.605730 O\n0.500000 0.603868 0.091783 O\n",
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},
{
"id": "mp-1247890",
"created_at": "2022-09-04T14:41:10.074319Z",
"structure_string": "Al16 Si8 O40\n1.0\n5.706032 0.000000 0.000000\n0.000000 10.903725 10.873720\n0.000000 -0.276934 11.175575\nAl Si O\n16 8 40\ndirect\n0.002342 0.000822 0.003076 Al\n0.001483 0.496041 0.990059 Al\n0.999996 0.504560 0.486456 Al\n0.250000 0.430965 0.303531 Al\n0.250000 0.261597 0.800757 Al\n0.250000 0.751447 0.829665 Al\n0.500004 0.504560 0.486456 Al\n0.507347 0.995832 0.508437 Al\n0.497658 0.000822 0.003076 Al\n0.498517 0.496041 0.990059 Al\n0.750000 0.238812 0.189161 Al\n0.750000 0.066421 0.696763 Al\n0.750000 0.750320 0.320793 Al\n0.750000 0.573650 0.673953 Al\n0.750000 0.050348 0.203273 Al\n0.992653 0.995832 0.508437 Al\n0.250000 0.948273 0.806313 Si\n0.250000 0.453580 0.786785 Si\n0.250000 0.247941 0.295206 Si\n0.250000 0.755812 0.291935 Si\n0.250000 0.934826 0.308674 Si\n0.750000 0.549743 0.182366 Si\n0.750000 0.249103 0.701766 Si\n0.750000 0.740022 0.820485 Si\n0.011989 0.001375 0.824899 O\n0.014906 0.508000 0.804993 O\n0.015575 0.172702 0.321675 O\n0.014186 0.682306 0.322390 O\n0.250000 0.110175 0.905992 O\n0.250000 0.002753 0.613165 O\n0.250000 0.605344 0.909970 O\n0.250000 0.310551 0.903276 O\n0.250000 0.508047 0.596885 O\n0.250000 0.803964 0.928392 O\n0.250000 0.279524 0.406605 O\n0.250000 0.381809 0.099511 O\n0.250000 0.887814 0.101246 O\n0.250000 0.792613 0.400798 O\n0.250000 0.488902 0.394463 O\n0.250000 0.962771 0.427385 O\n0.484425 0.172702 0.321675 O\n0.488011 0.001375 0.824899 O\n0.485814 0.682306 0.322390 O\n0.485094 0.508000 0.804993 O\n0.512487 0.491905 0.176086 O\n0.512473 0.324875 0.669409 O\n0.485116 0.994758 0.188552 O\n0.516832 0.816986 0.711854 O\n0.750000 0.202373 0.075373 O\n0.750000 0.015579 0.599198 O\n0.750000 0.390690 0.085079 O\n0.750000 0.218484 0.589550 O\n0.750000 0.516644 0.356719 O\n0.750000 0.511804 0.583924 O\n0.750000 0.115207 0.896884 O\n0.750000 0.693793 0.006070 O\n0.750000 0.894294 0.115415 O\n0.750000 0.724825 0.497680 O\n0.750000 0.610901 0.870957 O\n0.750000 0.987956 0.408267 O\n0.987513 0.491905 0.176086 O\n0.987527 0.324875 0.669409 O\n0.014884 0.994758 0.188552 O\n0.983168 0.816986 0.711854 O\n",
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{
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"structure_string": "Y6 Al15 Ni15\n1.0\n4.060811 0.000000 0.000000\n0.000000 8.894558 0.000000\n0.000000 0.013299 15.470182\nY Al Ni\n6 15 15\ndirect\n0.000000 0.999316 0.336644 Y\n0.000000 0.503813 0.835701 Y\n0.000000 0.505913 0.168867 Y\n0.000000 0.002504 0.663926 Y\n0.500000 0.992692 0.000585 Y\n0.500000 0.496992 0.496487 Y\n0.500000 0.009046 0.501504 Al\n0.500000 0.508245 0.000435 Al\n0.500000 0.748187 0.255647 Al\n0.500000 0.252784 0.751336 Al\n0.500000 0.249625 0.248948 Al\n0.500000 0.752653 0.748341 Al\n0.000000 0.146528 0.852375 Al\n0.000000 0.146977 0.148177 Al\n0.000000 0.648138 0.647819 Al\n0.000000 0.296946 0.000928 Al\n0.000000 0.783458 0.494208 Al\n0.000000 0.848912 0.141368 Al\n0.000000 0.349796 0.639952 Al\n0.000000 0.360020 0.360216 Al\n0.000000 0.849611 0.859427 Al\n0.500000 0.995999 0.183375 Ni\n0.500000 0.499899 0.680924 Ni\n0.500000 0.226501 0.405673 Ni\n0.500000 0.728085 0.907022 Ni\n0.500000 0.778385 0.410893 Ni\n0.500000 0.274604 0.910485 Ni\n0.500000 0.496018 0.316615 Ni\n0.500000 0.999915 0.817645 Ni\n0.500000 0.726534 0.094791 Ni\n0.500000 0.229559 0.593039 Ni\n0.500000 0.274728 0.090433 Ni\n0.500000 0.774441 0.588925 Ni\n0.000000 0.696094 0.000237 Ni\n0.000000 0.196048 0.499252 Ni\n0.000000 0.651234 0.347800 Ni\n",
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{
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