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{
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{
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{
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{
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{
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"structure_string": "Al40 O60\n1.0\n10.359306 0.092574 0.005776\n0.115323 10.358120 -0.344351\n0.001390 -0.323491 10.475798\nAl O\n40 60\ndirect\n0.347112 0.522168 0.260950 Al\n0.359930 0.100754 0.404427 Al\n0.538167 0.759425 0.642122 Al\n0.766963 0.872205 0.828630 Al\n0.299280 0.946584 0.696498 Al\n0.801457 0.618759 0.763985 Al\n0.319364 0.380642 0.527382 Al\n0.159201 0.890577 0.012952 Al\n0.423631 0.694055 0.082956 Al\n0.869630 0.494997 0.458844 Al\n0.742205 0.745982 0.411821 Al\n0.836109 0.258766 0.247317 Al\n0.917012 0.881523 0.292426 Al\n0.351168 0.823175 0.421284 Al\n0.071083 0.799951 0.541355 Al\n0.267557 0.106776 0.932526 Al\n0.957175 0.397491 0.958830 Al\n0.666455 0.247682 0.452638 Al\n0.631912 0.010989 0.387750 Al\n0.549872 0.153662 0.163866 Al\n0.062912 0.104566 0.200832 Al\n0.858518 0.088117 0.987954 Al\n0.675748 0.826892 0.158139 Al\n0.373583 0.986237 0.157604 Al\n0.063865 0.525104 0.644427 Al\n0.078722 0.269191 0.456100 Al\n0.733729 0.997757 0.625772 Al\n0.677405 0.340894 0.947580 Al\n0.541103 0.545381 0.488804 Al\n0.783494 0.534443 0.163542 Al\n0.262422 0.451055 0.976860 Al\n0.601137 0.440085 0.711439 Al\n0.282001 0.645246 0.723484 Al\n0.039729 0.438897 0.214279 Al\n0.117739 0.268052 0.724734 Al\n0.936785 0.723567 0.020838 Al\n0.399293 0.254183 0.792243 Al\n0.186478 0.717170 0.242049 Al\n0.566317 0.046369 0.909640 Al\n0.043876 0.993000 0.784627 Al\n0.921963 0.789734 0.441836 O\n0.425752 0.037371 0.005650 O\n0.623742 0.991299 0.755905 O\n0.510544 0.575125 0.663394 O\n0.314076 0.284982 0.938101 O\n0.037151 0.200876 0.593699 O\n0.291435 0.301719 0.677264 O\n0.732211 0.475469 0.813815 O\n0.896864 0.118576 0.150862 O\n0.311186 0.830263 0.079580 O\n0.381371 0.085577 0.784497 O\n0.047648 0.980664 0.301137 O\n0.870569 0.966119 0.726047 O\n0.592437 0.374582 0.550437 O\n0.563239 0.973344 0.210444 O\n0.698909 0.678814 0.248093 O\n0.653603 0.867279 0.528419 O\n0.890406 0.370056 0.140332 O\n0.880991 0.740886 0.864037 O\n0.394325 0.159629 0.231031 O\n0.895221 0.561360 0.024099 O\n0.212078 0.933367 0.860137 O\n0.280504 0.576819 0.872468 O\n0.844440 0.254179 0.921469 O\n0.357733 0.964523 0.537343 O\n0.108830 0.694367 0.671274 O\n0.473382 0.712868 0.480406 O\n0.175284 0.540739 0.259710 O\n0.045572 0.419392 0.789600 O\n0.378690 0.789537 0.714205 O\n0.673684 0.202577 0.273860 O\n0.377988 0.519389 0.092251 O\n0.415296 0.455624 0.397851 O\n0.114590 0.151411 0.838577 O\n0.570398 0.755306 0.042152 O\n0.182934 0.768351 0.411258 O\n0.660367 0.446656 0.083200 O\n0.249401 0.520507 0.601864 O\n0.189766 0.056830 0.089968 O\n0.367015 0.695886 0.260252 O\n0.090715 0.754705 0.097968 O\n0.050420 0.262758 0.285626 O\n0.854892 0.824712 0.133609 O\n0.552228 0.319741 0.810770 O\n0.912756 0.544427 0.298517 O\n0.327102 0.949857 0.312615 O\n0.814997 0.333192 0.409639 O\n0.521192 0.134483 0.450722 O\n0.108795 0.412045 0.047650 O\n0.123406 0.938365 0.638032 O\n0.042340 0.436404 0.489686 O\n0.680924 0.743803 0.741172 O\n0.707859 0.587570 0.468456 O\n0.751510 0.905153 0.322042 O\n0.609074 0.192954 0.009215 O\n0.988012 0.966482 0.949048 O\n0.891493 0.566218 0.626681 O\n0.746460 0.103796 0.505119 O\n0.254081 0.242460 0.440689 O\n0.724719 0.975168 0.968431 O\n",
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"structure_string": "Li2 Mn4 P4 O16\n1.0\n-3.425347 5.077530 0.127028\n1.713731 -0.125099 7.291017\n5.771888 5.159409 0.075071\nLi Mn P O\n2 4 4 16\ndirect\n0.183308 0.981922 0.502088 Li\n0.683284 0.981909 0.002129 Li\n0.854986 0.630813 0.884079 Mn\n0.625015 0.400941 0.601959 Mn\n0.354974 0.630616 0.384167 Mn\n0.125078 0.401116 0.101976 Mn\n0.912305 0.730508 0.266673 P\n0.412345 0.730502 0.766677 P\n0.092798 0.265484 0.735485 P\n0.592830 0.265508 0.235445 P\n0.082526 0.581084 0.261231 O\n0.582500 0.581077 0.761255 O\n0.300015 0.384742 0.603014 O\n0.800024 0.384767 0.103005 O\n0.351050 0.789011 0.581496 O\n0.851042 0.789019 0.081479 O\n0.029354 0.880140 0.342412 O\n0.529380 0.880152 0.842411 O\n0.038875 0.079943 0.688860 O\n0.538885 0.079950 0.188878 O\n0.646400 0.243413 0.429803 O\n0.146403 0.243423 0.929802 O\n0.694619 0.626235 0.390260 O\n0.194610 0.626282 0.890226 O\n0.898174 0.384687 0.716800 O\n0.398162 0.384699 0.216816 O\n",
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"formula_full": "Li2 Mn4 P4 O16",
"formula_reduced": "LiMn2(PO4)2",
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},
{
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"structure_string": "Pm6 Er2\n1.0\n3.662316 -6.343318 0.000000\n3.662316 6.343318 0.000000\n0.000000 0.000000 5.845841\nPm Er\n6 2\ndirect\n0.167166 0.334332 0.250000 Pm\n0.665668 0.832834 0.250000 Pm\n0.167166 0.832834 0.250000 Pm\n0.832834 0.665668 0.750000 Pm\n0.334332 0.167166 0.750000 Pm\n0.832834 0.167166 0.750000 Pm\n0.333333 0.666667 0.750000 Er\n0.666667 0.333333 0.250000 Er\n",
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"elements": [
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"density": 7.363988458640579,
"density_atomic": 0.029453756651722514,
"volume": 271.61221213974227,
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"formula_full": "Pm6 Er2",
"formula_reduced": "Pm3Er",
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"spacegroup": 194
},
{
"id": "mp-2130",
"created_at": "2022-09-04T14:46:27.512109Z",
"structure_string": "Lu2 Ni4\n1.0\n0.000000 3.527817 3.527817\n3.527817 0.000000 3.527817\n3.527817 3.527817 0.000000\nLu Ni\n2 4\ndirect\n0.750000 0.750000 0.750000 Lu\n0.500000 0.500000 0.500000 Lu\n0.125000 0.125000 0.125000 Ni\n0.625000 0.125000 0.125000 Ni\n0.125000 0.625000 0.125000 Ni\n0.125000 0.125000 0.625000 Ni\n",
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"elements": [
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],
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"density": 11.057060719801004,
"density_atomic": 0.06832869222447563,
"volume": 87.81084204405091,
"volume_molar": 8.813487517390012,
"formula_full": "Lu2 Ni4",
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"updated_at": "2021-11-28T01:37:40.656000Z",
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},
{
"id": "mp-1189016",
"created_at": "2022-09-04T14:46:09.839601Z",
"structure_string": "Mg2 U2 Pb4 O12\n1.0\n5.844562 0.000000 0.000000\n0.000000 5.874007 0.000000\n0.000000 5.750079 8.511779\nMg U Pb O\n2 2 4 12\ndirect\n0.000000 0.500000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.500000 U\n0.500000 0.000000 0.000000 U\n0.972453 0.281564 0.738742 Pb\n0.527547 0.281564 0.238742 Pb\n0.027547 0.718436 0.261258 Pb\n0.472453 0.718436 0.761258 Pb\n0.518776 0.303493 0.749398 O\n0.981224 0.303493 0.249398 O\n0.481224 0.696507 0.250602 O\n0.018776 0.696507 0.750602 O\n0.694810 0.712655 0.986121 O\n0.805190 0.712655 0.486121 O\n0.305190 0.287345 0.013879 O\n0.194810 0.287345 0.513879 O\n0.789090 0.176123 0.021751 O\n0.710910 0.176123 0.521751 O\n0.210910 0.823877 0.978249 O\n0.289090 0.823877 0.478249 O\n",
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"elements": [
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],
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"volume": 292.2178686760581,
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"formula_full": "Mg2 U2 Pb4 O12",
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]
}