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{
"id": "mp-754109",
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{
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{
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"structure_string": "K1 Sm1 Hf2 O6\n1.0\n0.000000 -4.115275 -4.115275\n4.115275 0.000000 -4.115275\n4.115275 -4.115275 0.000000\nK Sm Hf O\n1 1 2 6\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Sm\n0.250000 0.250000 0.250000 Hf\n0.750000 0.750000 0.750000 Hf\n0.000000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n",
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"formula_full": "K1 Sm1 Hf2 O6",
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"spacegroup": 225
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{
"id": "mp-18732",
"created_at": "2022-09-04T14:41:50.044780Z",
"structure_string": "Ti4 Ni4 O12\n1.0\n2.866147 -4.187099 0.000137\n6.163860 4.219329 6.274022\n-1.625474 -4.187041 2.360942\nTi Ni O\n4 4 12\ndirect\n0.928547 0.214365 0.142908 Ti\n0.428547 0.714368 0.142909 Ti\n0.571453 0.285633 0.857092 Ti\n0.071453 0.785636 0.857093 Ti\n0.174990 0.475050 0.650044 Ni\n0.825006 0.524952 0.349958 Ni\n0.674982 0.975066 0.650048 Ni\n0.325016 0.024936 0.349954 Ni\n0.077426 0.870075 0.562397 O\n0.577411 0.370080 0.562399 O\n0.692332 0.870072 0.230256 O\n0.192332 0.370073 0.230276 O\n0.360178 0.870074 0.947508 O\n0.860200 0.370077 0.947501 O\n0.422588 0.629919 0.437601 O\n0.922573 0.129925 0.437604 O\n0.807668 0.629925 0.769724 O\n0.307668 0.129926 0.769744 O\n0.139803 0.629923 0.052498 O\n0.639825 0.129926 0.052491 O\n",
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{
"id": "mp-561065",
"created_at": "2022-09-04T14:41:49.683143Z",
"structure_string": "Mg2 Ti4 P4 O20\n1.0\n7.470159 0.000000 0.000000\n0.000000 7.432991 0.000000\n0.000000 3.690838 6.468710\nMg Ti P O\n2 4 4 20\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.278501 0.266640 0.705582 Ti\n0.721499 0.733360 0.294418 Ti\n0.221499 0.266640 0.205582 Ti\n0.778501 0.733360 0.794418 Ti\n0.379776 0.755392 0.994411 P\n0.120224 0.755392 0.494411 P\n0.620224 0.244608 0.005589 P\n0.879776 0.244608 0.505589 P\n0.767133 0.442767 0.428223 O\n0.250386 0.940874 0.414209 O\n0.249614 0.940874 0.914209 O\n0.493445 0.738971 0.175303 O\n0.732867 0.442767 0.928223 O\n0.504223 0.786291 0.814035 O\n0.750386 0.059126 0.085791 O\n0.495777 0.213709 0.185965 O\n0.342157 0.231348 0.500133 O\n0.157843 0.231348 0.000133 O\n0.004223 0.213709 0.685965 O\n0.006555 0.738971 0.675303 O\n0.657843 0.768652 0.499867 O\n0.506555 0.261029 0.824697 O\n0.232867 0.557233 0.571777 O\n0.842157 0.768652 0.999867 O\n0.995777 0.786291 0.314035 O\n0.267133 0.557233 0.071777 O\n0.749614 0.059126 0.585791 O\n0.993445 0.261029 0.324697 O\n",
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"formula_full": "Mg2 Ti4 P4 O20",
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{
"id": "mp-1523185",
"created_at": "2022-09-04T14:41:50.721407Z",
"structure_string": "K4 Sr4 Ce4 Bi4 O24\n1.0\n8.620879 0.000000 0.000000\n0.000000 8.641827 0.000000\n0.000000 0.000000 8.641103\nK Sr Ce Bi O\n4 4 4 4 24\ndirect\n0.500000 -0.000000 0.500000 K\n0.500000 0.500000 0.000000 K\n-0.000000 0.500000 -0.000000 K\n-0.000000 -0.000000 0.500000 K\n-0.000000 0.500000 0.500000 Sr\n0.500000 -0.000000 -0.000000 Sr\n-0.000000 -0.000000 -0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.250000 0.250000 0.250000 Ce\n0.750000 0.750000 0.250000 Ce\n0.750000 0.250000 0.750000 Ce\n0.250000 0.750000 0.750000 Ce\n0.750000 0.750000 0.750000 Bi\n0.250000 0.250000 0.750000 Bi\n0.250000 0.750000 0.250000 Bi\n0.750000 0.250000 0.250000 Bi\n0.995240 0.222177 0.272994 O\n0.004760 0.777823 0.272994 O\n0.004760 0.222177 0.727006 O\n0.995240 0.777823 0.727006 O\n0.275145 0.993441 0.207366 O\n0.275145 0.006559 0.792634 O\n0.724855 0.006559 0.207366 O\n0.724855 0.993441 0.792634 O\n0.219871 0.265030 0.995463 O\n0.780129 0.265030 0.004537 O\n0.219871 0.734970 0.004537 O\n0.780129 0.734970 0.995463 O\n0.504760 0.277823 0.227006 O\n0.495240 0.722177 0.227006 O\n0.495240 0.277823 0.772994 O\n0.504760 0.722177 0.772994 O\n0.224855 0.506559 0.292634 O\n0.224855 0.493441 0.707366 O\n0.775145 0.493441 0.292634 O\n0.775145 0.506559 0.707366 O\n0.280129 0.234970 0.504537 O\n0.719871 0.234970 0.495463 O\n0.280129 0.765030 0.495463 O\n0.719871 0.765030 0.504537 O\n",
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"formula_full": "K4 Sr4 Ce4 Bi4 O24",
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{
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"structure_string": "Al12 Cr4 O24\n1.0\n-0.000506 5.634448 4.426451\n-4.880383 -2.817185 4.426972\n7.319218 -4.225492 -0.001293\nAl Cr O\n12 4 24\ndirect\n0.973155 0.473169 0.648738 Al\n0.473143 0.973159 0.648728 Al\n0.223212 0.223202 0.148823 Al\n0.723181 0.723173 0.148783 Al\n0.975235 0.975237 0.650128 Al\n0.475250 0.475230 0.650127 Al\n0.225225 0.725244 0.150164 Al\n0.725226 0.225237 0.150168 Al\n0.528970 0.028961 0.352616 Al\n0.028977 0.528957 0.352623 Al\n0.779009 0.779016 0.852669 Al\n0.279008 0.279024 0.852677 Al\n0.527410 0.527402 0.351580 Cr\n0.277385 0.777390 0.851557 Cr\n0.027476 0.027493 0.351636 Cr\n0.777495 0.277450 0.851649 Cr\n0.044653 0.704117 0.594498 O\n0.544639 0.204079 0.594503 O\n0.294562 0.454044 0.094441 O\n0.794545 0.954029 0.094434 O\n0.780519 0.968294 0.747281 O\n0.280508 0.468296 0.747287 O\n0.030439 0.718202 0.247303 O\n0.530433 0.218227 0.247322 O\n0.798074 0.950804 0.406879 O\n0.298077 0.450856 0.406914 O\n0.047946 0.700753 0.906898 O\n0.547857 0.200760 0.906931 O\n0.729983 0.528205 0.244689 O\n0.229964 0.028174 0.244634 O\n0.979915 0.278330 0.744550 O\n0.479916 0.778318 0.744534 O\n0.709869 0.548396 0.607886 O\n0.209870 0.048404 0.607914 O\n0.959754 0.298432 0.107708 O\n0.459708 0.798444 0.107638 O\n0.447642 0.810549 0.405891 O\n0.947641 0.310582 0.405913 O\n0.697657 0.560783 0.906042 O\n0.197676 0.060776 0.906051 O\n",
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{
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"structure_string": "Sr8 Mn4 Nb4 O24\n1.0\n5.744344 -5.743419 -0.000036\n-5.740816 -5.739891 -0.000211\n0.001644 -5.741814 -7.885447\nSr Mn Nb O\n8 4 4 24\ndirect\n0.874944 0.374965 0.750128 Sr\n0.625061 0.625082 0.249880 Sr\n0.125074 0.125082 0.249878 Sr\n0.374972 0.874971 0.750096 Sr\n0.375055 0.375049 0.749856 Sr\n0.124947 0.624946 0.250084 Sr\n0.624940 0.124921 0.250103 Sr\n0.875055 0.875047 0.749864 Sr\n0.249917 0.250065 0.500061 Mn\n0.000072 0.500025 0.000134 Mn\n0.500002 0.999969 0.999871 Mn\n0.750020 0.749799 0.500118 Mn\n0.499995 0.499966 0.000057 Nb\n0.250016 0.750033 0.500001 Nb\n0.749969 0.249969 0.499997 Nb\n0.999965 0.999994 0.000052 Nb\n0.128508 0.128460 0.743219 O\n0.878510 0.378408 0.243257 O\n0.378545 0.878466 0.243164 O\n0.628543 0.628395 0.743218 O\n0.371450 0.371600 0.256788 O\n0.121451 0.621555 0.756830 O\n0.621483 0.121584 0.756749 O\n0.871488 0.871528 0.256789 O\n0.993586 0.289593 0.500227 O\n0.743747 0.539740 0.999946 O\n0.243741 0.039729 0.999967 O\n0.493647 0.789590 0.500225 O\n0.256402 0.460436 0.999729 O\n0.006240 0.710265 0.500020 O\n0.506287 0.210300 0.500017 O\n0.756376 0.960418 0.999772 O\n0.289794 0.506171 0.499853 O\n0.039657 0.756069 0.000087 O\n0.539609 0.256035 0.000161 O\n0.789759 0.006199 0.499854 O\n0.960224 0.243825 0.000124 O\n0.710364 0.493929 0.499850 O\n0.210363 0.993990 0.499854 O\n0.460221 0.743833 0.000120 O\n",
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{
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{
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{
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}