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{
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{
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{
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{
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"structure_string": "Li9 Mn7 O16\n1.0\n5.996108 0.000000 0.000000\n-0.444134 6.040498 0.000000\n-0.053630 -0.122458 8.191671\nLi Mn O\n9 7 16\ndirect\n0.253483 0.743628 0.745624 Li\n0.000000 0.500000 0.500000 Li\n0.500000 0.500000 0.000000 Li\n0.254991 0.256368 0.743940 Li\n0.746517 0.256372 0.254376 Li\n0.500000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 Li\n0.745009 0.743632 0.256060 Li\n0.500000 0.500000 0.500000 Li\n0.743547 0.750139 0.747375 Mn\n0.500000 0.000000 0.500000 Mn\n0.256453 0.249861 0.252625 Mn\n0.000000 0.000000 0.000000 Mn\n0.743156 0.258085 0.747032 Mn\n0.256844 0.741915 0.252968 Mn\n0.000000 0.500000 0.000000 Mn\n0.979728 0.997071 0.760850 O\n0.723335 0.778024 0.511889 O\n0.240041 0.734712 0.012918 O\n0.995501 0.486460 0.755768 O\n0.475771 0.496880 0.249106 O\n0.241022 0.234092 0.011317 O\n0.740660 0.235682 0.512107 O\n0.499536 0.982872 0.263587 O\n0.524229 0.503120 0.750894 O\n0.276665 0.221976 0.488111 O\n0.759959 0.265288 0.987082 O\n0.500464 0.017128 0.736413 O\n0.020272 0.002929 0.239150 O\n0.758978 0.765908 0.988683 O\n0.259340 0.764318 0.487893 O\n0.004499 0.513540 0.244232 O\n",
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{
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"structure_string": "Al2 Au2 O4\n1.0\n1.466929 -2.540795 0.000000\n1.466929 2.540795 0.000000\n0.000000 0.000000 12.377068\nAl Au O\n2 2 4\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.666667 0.333333 0.750000 Au\n0.333333 0.666667 0.250000 Au\n0.333333 0.666667 0.423366 O\n0.666667 0.333333 0.923366 O\n0.333333 0.666667 0.076634 O\n0.666667 0.333333 0.576634 O\n",
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{
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{
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{
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{
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"structure_string": "Nd16 Al2 Si6 N6 O30\n1.0\n9.771814 -0.258501 -4.306757\n-0.259254 8.788820 0.091864\n-0.292110 0.144374 11.280097\nNd Al Si N O\n16 2 6 6 30\ndirect\n0.071684 0.307278 0.919543 Nd\n0.030487 0.124969 0.355373 Nd\n0.161585 0.546631 0.662771 Nd\n0.401783 0.124999 0.977875 Nd\n0.265477 0.940508 0.192928 Nd\n0.361388 0.413337 0.469124 Nd\n0.397754 0.932605 0.568622 Nd\n0.581066 0.435578 0.819274 Nd\n0.331448 0.650587 0.008673 Nd\n0.639380 0.982989 0.348352 Nd\n0.772197 0.577784 0.592254 Nd\n0.766189 0.056974 0.820242 Nd\n0.665720 0.818947 0.062032 Nd\n0.672052 0.437476 0.214622 Nd\n0.017625 0.959771 0.666624 Nd\n0.949068 0.554564 0.131354 Nd\n0.030967 0.795782 0.923231 Al\n0.252809 0.213718 0.648398 Al\n0.124457 0.759609 0.414570 Si\n0.744973 0.717236 0.823850 Si\n0.390863 0.291690 0.217661 Si\n0.836250 0.762731 0.345615 Si\n0.905449 0.291184 0.548879 Si\n0.770016 0.208297 0.042132 Si\n0.063202 0.274130 0.546401 N\n0.261446 0.181613 0.089373 N\n0.866251 0.816220 0.953352 N\n0.669625 0.701859 0.251880 N\n0.967756 0.665609 0.336216 N\n0.878217 0.301330 0.193271 N\n0.225375 0.106147 0.771879 O\n0.930209 0.385491 0.685947 O\n0.026308 0.308753 0.203944 O\n0.153167 0.904491 0.329665 O\n0.144357 0.846621 0.552617 O\n0.257066 0.647359 0.467490 O\n0.215614 0.458864 0.862198 O\n0.341658 0.400023 0.678565 O\n0.096974 0.591598 0.017280 O\n0.185304 0.655925 0.153049 O\n0.272535 0.162076 0.500738 O\n0.480904 0.657671 0.891014 O\n0.542292 0.200891 0.238608 O\n0.448570 0.106190 0.750950 O\n0.349022 0.728752 0.800043 O\n0.547250 0.171196 0.695962 O\n0.457557 0.927947 0.394870 O\n0.574352 0.479391 0.601127 O\n0.458646 0.904527 0.092515 O\n0.634495 0.833271 0.711491 O\n0.428776 0.451277 0.146037 O\n0.843039 0.792955 0.493566 O\n0.611776 0.272023 0.012113 O\n0.818106 0.306886 0.930817 O\n0.715938 0.572764 0.040823 O\n0.798096 0.410348 0.441733 O\n0.825980 0.118805 0.529223 O\n0.970422 0.079714 0.821935 O\n0.959772 0.729326 0.754146 O\n0.839254 0.942711 0.285167 O\n",
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"formula_full": "Nd16 Al2 Si6 N6 O30",
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"updated_at": "2021-11-28T01:36:56.703000Z",
"spacegroup": 1
},
{
"id": "mp-1094992",
"created_at": "2022-09-04T14:46:11.143904Z",
"structure_string": "Mg2 Ga2\n1.0\n2.234570 -3.870389 0.000000\n2.234570 3.870389 0.000000\n0.000000 0.000000 7.312629\nMg Ga\n2 2\ndirect\n0.666667 0.333333 0.625101 Mg\n0.333333 0.666667 0.125101 Mg\n0.666667 0.333333 0.999900 Ga\n0.333333 0.666667 0.499900 Ga\n",
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"elements": [
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],
"chemical_system": "Ga-Mg",
"density": 2.46879014497198,
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"volume": 126.48881288857937,
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"formula_full": "Mg2 Ga2",
"formula_reduced": "MgGa",
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"updated_at": "2021-11-28T01:37:23.316000Z",
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}
]
}