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{
"id": "mp-1044866",
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"structure_string": "Zn6 Sb12 O24\n1.0\n5.979838 0.000000 0.000000\n-2.320701 5.581634 0.000000\n-1.723721 -1.712493 21.019066\nZn Sb O\n6 12 24\ndirect\n0.876966 0.173223 0.937450 Zn\n0.509473 0.511784 0.584438 Zn\n0.456255 0.474570 0.030105 Zn\n0.179303 0.780350 0.302448 Zn\n0.794496 0.179248 0.715967 Zn\n0.422575 0.462303 0.368508 Zn\n0.803910 0.640701 0.834842 Sb\n0.307479 0.702305 0.907320 Sb\n0.468058 0.949419 0.457032 Sb\n0.341268 0.146339 0.817803 Sb\n0.116546 0.776454 0.690781 Sb\n0.922246 0.088748 0.570330 Sb\n0.230802 0.215809 0.213770 Sb\n0.972152 0.513478 0.456505 Sb\n0.581535 0.800300 0.177877 Sb\n0.848029 0.168184 0.324296 Sb\n0.834926 0.315375 0.094488 Sb\n0.123438 0.892639 0.060527 Sb\n0.730318 0.310622 0.867540 O\n0.448661 0.491619 0.800588 O\n0.663852 0.821192 0.920480 O\n0.240798 0.402756 0.951093 O\n0.470707 0.007028 0.749141 O\n0.357394 0.649789 0.504660 O\n0.923738 0.533903 0.750357 O\n0.248491 0.901733 0.978123 O\n0.270875 0.214671 0.599754 O\n0.132037 0.793975 0.405520 O\n0.038420 0.030904 0.739493 O\n0.809669 0.776637 0.614253 O\n0.096879 0.306899 0.403511 O\n0.195551 0.110522 0.303417 O\n0.586348 0.816080 0.386505 O\n0.803076 0.266051 0.627076 O\n0.909887 0.105611 0.031877 O\n0.050070 0.447963 0.274809 O\n0.694884 0.361829 0.379083 O\n0.366658 0.931906 0.218753 O\n0.819282 0.536984 0.028889 O\n0.521592 0.523912 0.233090 O\n0.470759 0.212775 0.088177 O\n0.360601 0.653412 0.099326 O\n",
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{
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"structure_string": "Sr2 Li2 B18 O30\n1.0\n6.700538 -5.409787 0.000000\n6.700538 5.409787 0.000000\n2.332861 0.000000 8.289799\nSr Li B O\n2 2 18 30\ndirect\n0.492192 0.492192 0.492192 Sr\n0.992192 0.992192 0.992192 Sr\n0.233133 0.233133 0.233133 Li\n0.733133 0.733133 0.733133 Li\n0.625130 0.768866 0.103893 B\n0.711286 0.275309 0.833660 B\n0.333660 0.775309 0.211286 B\n0.211286 0.333660 0.775309 B\n0.268866 0.125130 0.603893 B\n0.603893 0.268866 0.125130 B\n0.125130 0.603893 0.268866 B\n0.275309 0.833660 0.711286 B\n0.768866 0.103893 0.625130 B\n0.103893 0.625130 0.768866 B\n0.280579 0.939762 0.422768 B\n0.422768 0.280579 0.939762 B\n0.939762 0.422768 0.280579 B\n0.780579 0.922768 0.439762 B\n0.439762 0.780579 0.922768 B\n0.922768 0.439762 0.780579 B\n0.833660 0.711286 0.275309 B\n0.775309 0.211286 0.333660 B\n0.769121 0.795330 0.125314 O\n0.125314 0.769121 0.795330 O\n0.231081 0.505055 0.735152 O\n0.505055 0.735152 0.231081 O\n0.795330 0.125314 0.769121 O\n0.005055 0.731081 0.235152 O\n0.731081 0.235152 0.005055 O\n0.235152 0.005055 0.731081 O\n0.274761 0.259737 0.925487 O\n0.259737 0.925487 0.274761 O\n0.925487 0.274761 0.259737 O\n0.759737 0.774761 0.425487 O\n0.774761 0.425487 0.759737 O\n0.425487 0.759737 0.774761 O\n0.269121 0.625314 0.295330 O\n0.295330 0.269121 0.625314 O\n0.307477 0.811263 0.542484 O\n0.542484 0.307477 0.811263 O\n0.811263 0.542484 0.307477 O\n0.807477 0.042484 0.311263 O\n0.311263 0.807477 0.042484 O\n0.042484 0.311263 0.807477 O\n0.274974 0.098397 0.446889 O\n0.446889 0.274974 0.098397 O\n0.098397 0.446889 0.274974 O\n0.774974 0.946889 0.598397 O\n0.598397 0.774974 0.946889 O\n0.946889 0.598397 0.774974 O\n0.735152 0.231081 0.505055 O\n0.625314 0.295330 0.269121 O\n",
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"formula_full": "Sr2 Li2 B18 O30",
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"spacegroup": 161
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{
"id": "mp-1223348",
"created_at": "2022-09-04T14:39:07.010978Z",
"structure_string": "La10 Fe8 Ni2 O30\n1.0\n2.777192 4.866141 0.000000\n-2.777192 4.866141 0.000000\n0.000000 3.204502 22.959062\nLa Fe Ni O\n10 8 2 30\ndirect\n0.746805 0.746805 0.748645 La\n0.945089 0.945089 0.153273 La\n0.345583 0.345583 0.951755 La\n0.147180 0.147180 0.551283 La\n0.545795 0.545795 0.355023 La\n0.454205 0.454205 0.644977 La\n0.654417 0.654417 0.048245 La\n0.054911 0.054911 0.846727 La\n0.852820 0.852820 0.448717 La\n0.253195 0.253195 0.251355 La\n0.599670 0.599670 0.200892 Fe\n0.000000 0.000000 0.000000 Fe\n0.400330 0.400330 0.799108 Fe\n0.500000 0.500000 0.500000 Fe\n0.899933 0.899933 0.301299 Fe\n0.299601 0.299601 0.100784 Fe\n0.700399 0.700399 0.899216 Fe\n0.100067 0.100067 0.698701 Fe\n0.799828 0.799828 0.599718 Ni\n0.200172 0.200172 0.400282 Ni\n0.279225 0.781445 0.760112 O\n0.479956 0.979428 0.160339 O\n0.879817 0.381346 0.960215 O\n0.679533 0.180151 0.558481 O\n0.080113 0.580151 0.359027 O\n0.419849 0.919887 0.640973 O\n0.618654 0.120183 0.039785 O\n0.020572 0.520044 0.839661 O\n0.819849 0.320467 0.441519 O\n0.218555 0.720775 0.239888 O\n0.919887 0.419849 0.640973 O\n0.120183 0.618654 0.039785 O\n0.520044 0.020572 0.839661 O\n0.320467 0.819849 0.441519 O\n0.720775 0.218555 0.239888 O\n0.781445 0.279225 0.760112 O\n0.979428 0.479956 0.160339 O\n0.381346 0.879817 0.960215 O\n0.180151 0.679533 0.558481 O\n0.580151 0.080113 0.359027 O\n0.680029 0.680029 0.532111 O\n0.081888 0.081888 0.332194 O\n0.486056 0.486056 0.132142 O\n0.886805 0.886805 0.931665 O\n0.286569 0.286569 0.731842 O\n0.319971 0.319971 0.467889 O\n0.713431 0.713431 0.268158 O\n0.113195 0.113195 0.068335 O\n0.513944 0.513944 0.867858 O\n0.918112 0.918112 0.667806 O\n",
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"formula_full": "La10 Fe8 Ni2 O30",
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{
"id": "mp-1028250",
"created_at": "2022-09-04T14:39:07.013682Z",
"structure_string": "Sr1 Mg14 Al1\n1.0\n6.499927 -0.000000 -0.000000\n-3.249964 5.629101 -0.000000\n-0.000000 0.000000 10.622328\nSr Mg Al\n1 14 1\ndirect\n0.166667 0.333333 0.625000 Sr\n0.161174 0.830587 0.125000 Mg\n0.178005 0.839002 0.625000 Mg\n0.669413 0.338826 0.125000 Mg\n0.660998 0.321995 0.625000 Mg\n0.669413 0.830587 0.125000 Mg\n0.660998 0.839002 0.625000 Mg\n0.334444 0.165556 0.361096 Mg\n0.334444 0.165556 0.888904 Mg\n0.334444 0.668890 0.361096 Mg\n0.334444 0.668890 0.888904 Mg\n0.831110 0.165556 0.361096 Mg\n0.831110 0.165556 0.888904 Mg\n0.833333 0.666667 0.381346 Mg\n0.833333 0.666667 0.868654 Mg\n0.166667 0.333333 0.125000 Al\n",
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{
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"structure_string": "Fe6 B2\n1.0\n2.366513 -4.098922 0.000000\n2.366513 4.098922 0.000000\n0.000000 0.000000 4.356557\nFe B\n6 2\ndirect\n0.306259 0.306259 0.000000 Fe\n0.693741 0.000000 0.000000 Fe\n0.000000 0.693741 0.000000 Fe\n0.693741 0.693741 0.500000 Fe\n0.306259 0.000000 0.500000 Fe\n0.000000 0.306259 0.500000 Fe\n0.333333 0.666667 0.250000 B\n0.666667 0.333333 0.750000 B\n",
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{
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"structure_string": "Li6 Ti4 P6 O24\n1.0\n2.736587 4.147087 0.000000\n-2.736587 4.147087 0.000000\n0.000000 0.143536 18.614181\nLi Ti P O\n6 4 6 24\ndirect\n0.999907 0.999907 0.167521 Li\n0.329372 0.329372 0.912493 Li\n0.330092 0.330092 0.245555 Li\n0.000093 0.000093 0.832479 Li\n0.669908 0.669908 0.754445 Li\n0.670628 0.670628 0.087507 Li\n0.000000 0.000000 0.500000 Ti\n0.998336 0.998336 0.336391 Ti\n0.001664 0.001664 0.663609 Ti\n0.000000 0.000000 0.000000 Ti\n0.347718 0.347718 0.747150 P\n0.346253 0.346253 0.416802 P\n0.351049 0.351049 0.080575 P\n0.653747 0.653747 0.583198 P\n0.648951 0.648951 0.919425 P\n0.652282 0.652282 0.252850 P\n0.690531 0.225881 0.417722 O\n0.692274 0.235176 0.741427 O\n0.695183 0.238828 0.076967 O\n0.774119 0.309469 0.582278 O\n0.761172 0.304817 0.923033 O\n0.764824 0.307726 0.258573 O\n0.764054 0.764054 0.517177 O\n0.749911 0.749911 0.851285 O\n0.244939 0.244939 0.347280 O\n0.232073 0.232073 0.682397 O\n0.235946 0.235946 0.482823 O\n0.746988 0.746988 0.183010 O\n0.757222 0.757222 0.987467 O\n0.755061 0.755061 0.652720 O\n0.253012 0.253012 0.816990 O\n0.242778 0.242778 0.012533 O\n0.767927 0.767927 0.317603 O\n0.250089 0.250089 0.148715 O\n0.309469 0.774119 0.582278 O\n0.307726 0.764824 0.258573 O\n0.225881 0.690531 0.417722 O\n0.304817 0.761172 0.923033 O\n0.238828 0.695183 0.076967 O\n0.235176 0.692274 0.741427 O\n",
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{
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