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{
"id": "mp-1096823",
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"structure_string": "Al24 Zn2 S38\n1.0\n3.529246 -6.112833 0.000000\n3.529246 6.112833 0.000000\n0.000000 0.000000 27.517307\nAl Zn S\n24 2 38\ndirect\n0.168142 0.831858 0.610445 Al\n0.168142 0.336284 0.610445 Al\n0.663716 0.831858 0.610445 Al\n0.831858 0.168142 0.389555 Al\n0.831858 0.663716 0.389555 Al\n0.336284 0.168142 0.389555 Al\n0.831858 0.168142 0.110445 Al\n0.831858 0.663716 0.110445 Al\n0.336284 0.168142 0.110445 Al\n0.168142 0.831858 0.889555 Al\n0.168142 0.336284 0.889555 Al\n0.663716 0.831858 0.889555 Al\n0.333333 0.666667 0.473513 Al\n0.666667 0.333333 0.526487 Al\n0.666667 0.333333 0.973513 Al\n0.333333 0.666667 0.026487 Al\n0.333333 0.666667 0.309746 Al\n0.666667 0.333333 0.690254 Al\n0.666667 0.333333 0.809746 Al\n0.333333 0.666667 0.190254 Al\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.250000 Al\n0.000000 0.000000 0.750000 Al\n0.333333 0.666667 0.750000 Zn\n0.666667 0.333333 0.250000 Zn\n0.155243 0.844757 0.445540 S\n0.155243 0.310486 0.445540 S\n0.689514 0.844757 0.445540 S\n0.844757 0.155243 0.554460 S\n0.844757 0.689514 0.554460 S\n0.310486 0.155243 0.554460 S\n0.844757 0.155243 0.945540 S\n0.844757 0.689514 0.945540 S\n0.310486 0.155243 0.945540 S\n0.155243 0.844757 0.054460 S\n0.155243 0.310486 0.054460 S\n0.689514 0.844757 0.054460 S\n0.510662 0.489338 0.344283 S\n0.510662 0.021325 0.344283 S\n0.978675 0.489338 0.344283 S\n0.489338 0.510662 0.655717 S\n0.489338 0.978675 0.655717 S\n0.021325 0.510662 0.655717 S\n0.489338 0.510662 0.844283 S\n0.489338 0.978675 0.844283 S\n0.021325 0.510662 0.844283 S\n0.510662 0.489338 0.155717 S\n0.510662 0.021325 0.155717 S\n0.978675 0.489338 0.155717 S\n0.333333 0.666667 0.556226 S\n0.666667 0.333333 0.443774 S\n0.666667 0.333333 0.056226 S\n0.333333 0.666667 0.943774 S\n0.000000 0.000000 0.346142 S\n0.000000 0.000000 0.653858 S\n0.000000 0.000000 0.846142 S\n0.000000 0.000000 0.153858 S\n0.183731 0.816269 0.250000 S\n0.183731 0.367462 0.250000 S\n0.632538 0.816269 0.250000 S\n0.816269 0.183731 0.750000 S\n0.816269 0.632538 0.750000 S\n0.367462 0.183731 0.750000 S\n",
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"formula_full": "Al24 Zn2 S38",
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"updated_at": "2021-11-28T01:34:51.984000Z",
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},
{
"id": "mp-531864",
"created_at": "2022-09-04T14:44:04.696213Z",
"structure_string": "Al24 Zn3 O40\n1.0\n2.861938 4.922778 0.000000\n-2.861938 4.922778 0.000000\n0.000000 3.306680 23.052058\nAl Zn O\n24 3 40\ndirect\n0.500403 0.500403 0.999330 Al\n0.702097 0.199249 0.897784 Al\n0.199249 0.702097 0.897784 Al\n0.969070 0.969070 0.572867 Al\n0.702280 0.702280 0.897607 Al\n0.096701 0.605651 0.702158 Al\n0.224237 0.224237 0.829719 Al\n0.605651 0.096701 0.702158 Al\n0.311281 0.311281 0.596058 Al\n0.097833 0.097833 0.701516 Al\n0.501465 0.989870 0.501469 Al\n0.397695 0.903349 0.295741 Al\n0.989870 0.501465 0.501469 Al\n0.695588 0.695588 0.398956 Al\n0.630089 0.630089 0.625587 Al\n0.775229 0.775229 0.172102 Al\n0.903349 0.397695 0.295741 Al\n0.030504 0.030504 0.423749 Al\n0.902591 0.902591 0.295847 Al\n0.292515 0.808296 0.105356 Al\n0.423344 0.423344 0.229749 Al\n0.808296 0.292515 0.105356 Al\n0.292693 0.292693 0.105629 Al\n0.824639 0.824639 0.027219 Al\n0.174712 0.174712 0.974154 Zn\n0.574714 0.574714 0.774797 Zn\n0.373577 0.373577 0.372653 Zn\n0.371542 0.810192 0.948328 O\n0.547742 0.547742 0.857347 O\n0.810192 0.371542 0.948328 O\n0.370709 0.370709 0.948325 O\n0.765013 0.233530 0.740104 O\n0.046412 0.046412 0.858040 O\n0.851170 0.851170 0.947731 O\n0.950345 0.950345 0.651241 O\n0.233530 0.765013 0.740104 O\n0.550537 0.046417 0.857861 O\n0.046417 0.550537 0.857861 O\n0.763715 0.763715 0.740242 O\n0.135183 0.630856 0.551471 O\n0.441333 0.441333 0.650197 O\n0.328342 0.328342 0.457792 O\n0.978829 0.436018 0.651484 O\n0.253015 0.253015 0.746673 O\n0.630856 0.135183 0.551471 O\n0.436018 0.978829 0.651484 O\n0.155085 0.155085 0.549939 O\n0.574655 0.007131 0.345068 O\n0.842980 0.842980 0.451492 O\n0.748733 0.748733 0.250407 O\n0.660292 0.660292 0.548585 O\n0.007131 0.574655 0.345068 O\n0.369556 0.866982 0.447109 O\n0.570257 0.570257 0.345722 O\n0.866982 0.369556 0.447109 O\n0.950981 0.452983 0.144129 O\n0.245971 0.245971 0.256514 O\n0.452983 0.950981 0.144129 O\n0.050854 0.050854 0.344714 O\n0.750525 0.246122 0.256377 O\n0.146294 0.146294 0.060960 O\n0.950990 0.950990 0.144038 O\n0.246122 0.750525 0.256377 O\n0.637196 0.637196 0.051965 O\n0.450527 0.450527 0.147771 O\n0.174184 0.637131 0.051946 O\n0.637131 0.174184 0.051946 O\n",
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"elements": [
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"formula_full": "Al24 Zn3 O40",
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"updated_at": "2021-11-28T01:36:19.663000Z",
"spacegroup": 8
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{
"id": "mp-1245145",
"created_at": "2022-09-04T14:44:58.417590Z",
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{
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{
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},
{
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{
"id": "mp-532510",
"created_at": "2022-09-04T14:40:09.147443Z",
"structure_string": "Al28 Ni14 O56\n1.0\n5.694254 0.000000 0.000000\n2.835996 4.988581 0.000000\n2.768154 1.689660 33.001051\nAl Ni O\n28 14 56\ndirect\n0.354596 0.863771 0.928907 Al\n0.355228 0.352799 0.928978 Al\n0.078924 0.567551 0.786134 Al\n0.220880 0.711231 0.855718 Al\n0.265271 0.771331 0.696802 Al\n0.078370 0.063044 0.785981 Al\n0.976736 0.491374 0.554893 Al\n0.887736 0.367187 0.874389 Al\n0.932753 0.423406 0.713988 Al\n0.787330 0.783564 0.642805 Al\n0.690858 0.206488 0.411951 Al\n0.603839 0.074802 0.732292 Al\n0.642846 0.143113 0.571434 Al\n0.499821 0.500246 0.499811 Al\n0.356453 0.858375 0.428489 Al\n0.404432 0.921831 0.269110 Al\n0.309983 0.791477 0.588217 Al\n0.213983 0.214983 0.356882 Al\n0.115317 0.640162 0.126978 Al\n0.070235 0.573594 0.285572 Al\n0.023414 0.507191 0.445271 Al\n0.927106 0.930876 0.214197 Al\n0.737345 0.222084 0.302383 Al\n0.782127 0.290230 0.142823 Al\n0.637627 0.649861 0.072072 Al\n0.498495 0.003472 0.998741 Al\n0.450484 0.938545 0.159572 Al\n0.164767 0.657342 0.015680 Al\n0.827539 0.345894 0.985189 Ni\n0.850322 0.860475 0.927807 Ni\n0.554426 0.053349 0.840129 Ni\n0.574688 0.567349 0.785366 Ni\n0.288454 0.281889 0.643035 Ni\n0.999733 0.999556 0.500166 Ni\n0.500102 0.999660 0.500185 Ni\n0.787880 0.282320 0.643319 Ni\n0.713910 0.714311 0.357248 Ni\n0.214267 0.714250 0.357263 Ni\n0.427267 0.430146 0.214489 Ni\n0.927365 0.429934 0.214479 Ni\n0.139618 0.149332 0.071732 Ni\n0.636506 0.148887 0.071730 Ni\n0.641383 0.717646 0.962743 O\n0.505453 0.049799 0.897373 O\n0.646684 0.177654 0.962043 O\n0.199295 0.167933 0.960511 O\n0.523933 0.542876 0.891596 O\n0.365157 0.426784 0.819726 O\n0.058623 0.536181 0.890488 O\n0.367740 0.885502 0.819116 O\n0.238493 0.753150 0.750918 O\n0.196085 0.672051 0.959395 O\n0.931876 0.872569 0.816535 O\n0.059376 0.012859 0.890058 O\n0.240599 0.253924 0.750892 O\n0.101946 0.121315 0.681745 O\n0.916494 0.378875 0.818047 O\n0.953168 0.483617 0.609564 O\n0.090390 0.607580 0.679033 O\n0.779057 0.240859 0.749140 O\n0.623389 0.608935 0.679963 O\n0.784005 0.720578 0.749417 O\n0.810238 0.840363 0.539072 O\n0.953250 0.957337 0.607311 O\n0.666191 0.200572 0.466694 O\n0.803094 0.325572 0.536920 O\n0.622042 0.079886 0.677905 O\n0.483418 0.956322 0.607313 O\n0.333643 0.325440 0.536982 O\n0.476399 0.443139 0.605306 O\n0.666853 0.673014 0.464342 O\n0.524257 0.555318 0.396141 O\n0.333732 0.798007 0.534146 O\n0.517406 0.040404 0.394024 O\n0.195968 0.672849 0.464326 O\n0.380292 0.915328 0.323836 O\n0.189182 0.158922 0.462244 O\n0.047602 0.040290 0.394014 O\n0.380914 0.387699 0.321404 O\n0.238097 0.270766 0.253205 O\n0.047921 0.512713 0.391187 O\n0.910166 0.387536 0.321371 O\n0.229798 0.757236 0.251343 O\n0.093477 0.630992 0.181599 O\n0.760882 0.756016 0.251249 O\n0.903077 0.873869 0.319368 O\n0.094319 0.103097 0.178474 O\n0.949158 0.987602 0.110460 O\n0.798400 0.350828 0.043294 O\n0.760573 0.229028 0.248235 O\n0.624238 0.102231 0.178474 O\n0.943967 0.474860 0.109124 O\n0.468871 0.476649 0.109352 O\n0.615695 0.590392 0.176681 O\n0.807703 0.819090 0.033317 O\n0.334987 0.823650 0.034432 O\n0.474755 0.946897 0.105061 O\n0.327250 0.308117 0.031282 O\n",
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}
]
}