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{
"id": "jvasp-50403",
"created_at": "2022-09-04T14:38:17.658406Z",
"updated_at": "2022-09-04T14:38:17.658424Z",
"structure_string": "Cd4 Ga8 O16\n1.0\n3.001702 0.000000 0.000000\n0.000000 9.228013 0.000000\n0.000000 0.000000 10.712534\nCd Ga O\n4 8 16\ndirect\n0.250000 0.757059 0.346745 Cd\n0.749999 0.742940 0.846745 Cd\n0.250000 0.257059 0.153255 Cd\n0.749999 0.242941 0.653255 Cd\n0.749999 0.083529 0.394771 Ga\n0.749999 0.064632 0.886812 Ga\n0.250000 0.416471 0.894771 Ga\n0.250000 0.435368 0.386812 Ga\n0.749999 0.564632 0.613187 Ga\n0.250000 0.935368 0.113188 Ga\n0.250000 0.916470 0.605228 Ga\n0.749999 0.583529 0.105228 Ga\n0.749999 0.470303 0.783221 O\n0.250000 0.115731 0.523330 O\n0.250000 0.204094 0.840679 O\n0.749999 0.295906 0.340680 O\n0.749999 0.384269 0.023330 O\n0.250000 0.418289 0.570556 O\n0.250000 0.529697 0.216779 O\n0.250000 0.918288 0.929443 O\n0.250000 0.615730 0.976670 O\n0.250000 0.704094 0.659320 O\n0.749999 0.795906 0.159320 O\n0.749999 0.884269 0.476670 O\n0.749999 0.081711 0.070557 O\n0.749999 0.970302 0.716779 O\n0.749999 0.581711 0.429443 O\n0.250000 0.029697 0.283221 O\n",
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{
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"structure_string": "Zn2 Cu4 O8\n1.0\n5.897667 0.064346 0.005295\n-0.346525 5.887880 -0.005867\n-2.779575 -2.971965 4.270300\nZn Cu O\n2 4 8\ndirect\n0.875027 0.624989 0.750001 Zn\n0.124979 0.375014 0.250004 Zn\n0.500003 0.000003 0.000004 Cu\n-0.000002 -0.000000 0.499999 Cu\n0.500001 -0.000005 0.500000 Cu\n0.500001 0.499998 -0.000001 Cu\n0.718744 0.175480 0.938181 O\n0.324473 0.262715 0.043234 O\n0.219478 0.781252 0.456773 O\n0.762717 0.719430 0.438195 O\n0.780517 0.218748 0.543226 O\n0.675525 0.737283 0.956764 O\n0.237276 0.280572 0.561805 O\n0.281257 0.824522 0.061820 O\n",
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"formula_full": "Zn2 Cu4 O8",
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{
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"updated_at": "2022-09-04T14:38:50.390173Z",
"structure_string": "V6 O8 F4\n1.0\n4.623959 -0.027189 0.012688\n0.045246 7.518622 -0.608680\n-0.015538 -0.035980 5.489860\nV O F\n6 8 4\ndirect\n0.010249 0.675185 0.689441 V\n0.513333 0.355747 0.824556 V\n0.013340 0.977589 0.008777 V\n0.510260 0.658143 0.143909 V\n0.470910 0.012178 0.482745 V\n0.970909 0.321153 0.350585 V\n0.200845 0.905027 0.697420 O\n0.700854 0.428312 0.135912 O\n0.298490 0.569462 0.864568 O\n0.798487 0.763867 0.968779 O\n0.802683 0.092480 0.296845 O\n0.305424 0.889867 0.200413 O\n0.805429 0.443464 0.632908 O\n0.302690 0.240845 0.536474 O\n0.696425 0.766327 0.465924 F\n0.701633 0.105701 0.799554 F\n0.201597 0.227651 0.033758 F\n0.196447 0.567000 0.367436 F\n",
"nsites": 18,
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{
"id": "jvasp-74781",
"created_at": "2022-09-04T14:36:18.885244Z",
"updated_at": "2022-09-04T14:36:18.885279Z",
"structure_string": "Mn1 Be2 Os1\n1.0\n-1.956887 1.956887 2.767755\n1.956887 -1.956887 2.767755\n1.956887 1.956887 -2.767755\nMn Be Os\n1 2 1\ndirect\n0.500001 0.500001 0.000000 Mn\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.750001 0.250000 0.500001 Os\n",
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{
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"structure_string": "Mn3 Rh1 N1\n1.0\n3.756164 0.000000 0.000000\n0.000000 3.756164 0.000000\n-0.000000 -0.000000 3.756164\nMn Rh N\n3 1 1\ndirect\n0.499999 0.499999 0.000000 Mn\n0.499999 0.000000 0.499999 Mn\n0.000000 0.499999 0.499999 Mn\n0.000000 0.000000 0.000000 Rh\n0.499999 0.499999 0.499999 N\n",
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{
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"created_at": "2022-09-04T14:37:29.155878Z",
"updated_at": "2022-09-04T14:37:29.155900Z",
"structure_string": "Li4 Fe2 F8\n1.0\n0.000000 5.346605 -0.111069\n5.242500 0.000000 0.000000\n0.000000 -2.553721 -5.240916\nLi Fe F\n4 2 8\ndirect\n0.371160 0.637533 0.843061 Li\n0.128757 0.707813 0.156910 Li\n0.871244 0.207813 0.843091 Li\n0.628841 0.137533 0.156940 Li\n0.250035 0.172695 0.500030 Fe\n0.749966 0.672695 0.499971 Fe\n0.981256 0.013470 0.627573 F\n0.021556 0.531872 0.849623 F\n0.521642 0.313541 0.849650 F\n0.481362 0.831956 0.627711 F\n0.518639 0.331956 0.372290 F\n0.478359 0.813541 0.150351 F\n0.978445 0.031872 0.150378 F\n0.018746 0.513470 0.372428 F\n",
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{
"id": "jvasp-9897",
"created_at": "2022-09-04T14:38:07.793228Z",
"updated_at": "2022-09-04T14:38:07.793250Z",
"structure_string": "Mg2 Cr1 W1 O6\n1.0\n5.145280 0.019549 -0.003208\n2.555645 4.465785 -0.004330\n2.569871 1.497902 4.620340\nMg Cr W O\n2 1 1 6\ndirect\n0.288294 0.290794 0.145418 Mg\n0.789422 0.791926 0.642016 Mg\n0.496292 0.498771 0.521455 Cr\n0.994910 0.997403 0.025571 W\n0.370546 0.105410 0.813827 O\n0.611624 0.886058 0.306731 O\n0.102894 0.725516 0.813826 O\n0.722990 0.373045 0.813847 O\n0.208381 0.614132 0.306724 O\n0.883565 0.210871 0.306729 O\n",
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"formula_full": "Mg2 Cr1 W1 O6",
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{
"id": "jvasp-9407",
"created_at": "2022-09-04T14:37:11.194586Z",
"updated_at": "2022-09-04T14:37:11.194607Z",
"structure_string": "Li4 Al4 O8\n1.0\n5.201815 -0.000000 -0.000000\n0.000000 5.201815 0.000000\n-0.000000 -0.000000 6.267666\nLi Al O\n4 4 8\ndirect\n0.686555 0.313446 0.250000 Li\n0.186555 0.186555 0.500000 Li\n0.313446 0.686555 0.750001 Li\n0.813446 0.813446 0.000000 Li\n0.825174 0.825174 0.500000 Al\n0.674827 0.325174 0.750001 Al\n0.325174 0.674827 0.250000 Al\n0.174827 0.174827 0.000000 Al\n0.293083 0.334086 0.229840 O\n0.165914 0.793084 0.479840 O\n0.793084 0.165914 0.520160 O\n0.834087 0.206917 0.979841 O\n0.206917 0.834087 0.020160 O\n0.665915 0.706918 0.270160 O\n0.334086 0.293083 0.770160 O\n0.706918 0.665915 0.729841 O\n",
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{
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"structure_string": "Be2 Fe1 Re1\n1.0\n-1.914041 1.914041 2.893342\n1.914041 -1.914041 2.893342\n1.914041 1.914041 -2.893342\nBe Fe Re\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.500000 0.500000 0.000000 Fe\n0.750000 0.250000 0.500000 Re\n",
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{
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"created_at": "2022-09-04T14:37:55.941431Z",
"updated_at": "2022-09-04T14:37:55.941443Z",
"structure_string": "Li1 V1 B1 O4\n1.0\n3.994033 -0.035106 -2.695924\n-1.147165 3.825904 -2.695924\n0.026364 0.035106 4.818673\nLi V B O\n1 1 1 4\ndirect\n0.500000 0.499999 0.000000 Li\n0.000000 0.000000 0.000000 V\n0.250000 0.749999 0.500000 B\n0.159204 0.697122 0.122210 O\n0.963004 0.840794 0.537917 O\n0.574912 0.036995 0.877790 O\n0.302877 0.425086 0.462083 O\n",
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"created_at": "2022-09-04T14:38:43.533058Z",
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"structure_string": "Na1 V4 Cd3 O12\n1.0\n5.276644 -0.007431 -0.017337\n-0.038479 5.331235 -0.017526\n0.025203 0.025438 7.536226\nNa V Cd O\n1 4 3 12\ndirect\n0.504898 0.531976 0.250023 Na\n0.996529 0.500786 0.005000 V\n0.503366 0.001438 0.496672 V\n0.996555 0.500792 0.494993 V\n0.503349 0.001424 0.003331 V\n0.998647 0.029399 0.249979 Cd\n0.490670 0.470456 0.750006 Cd\n0.006863 0.968082 0.749992 Cd\n0.063732 0.481990 0.250000 O\n0.426873 0.990281 0.250003 O\n0.711977 0.285816 0.034310 O\n0.793507 0.791192 0.458683 O\n0.293236 0.707849 0.536812 O\n0.711998 0.285831 0.465694 O\n0.293220 0.707852 0.963188 O\n0.207728 0.208491 0.539645 O\n0.577367 0.013910 0.750003 O\n0.793479 0.791167 0.041311 O\n0.207694 0.208464 0.960350 O\n0.918297 0.522819 0.749999 O\n",
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{
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}
]
}