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{
"id": "jvasp-121192",
"created_at": "2022-09-04T14:38:52.887467Z",
"updated_at": "2022-09-04T14:38:52.887487Z",
"structure_string": "Li1 Te1\n1.0\n4.679895 0.000000 -0.000000\n-2.339947 4.052908 0.000000\n-0.000000 -0.000000 3.144610\nLi Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.333332 0.666667 0.000000 Te\n",
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{
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"structure_string": "Cu1 B1 O4\n1.0\n-2.555207 2.555208 2.348508\n2.555207 -2.555208 2.348508\n2.555208 2.555207 -2.348508\nCu B O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Cu\n0.250000 0.750000 0.500000 B\n0.618670 0.081061 0.812058 O\n0.193389 0.381330 0.462392 O\n0.269004 0.806611 0.187942 O\n-0.081062 0.730996 0.537607 O\n",
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{
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{
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"updated_at": "2022-09-04T14:38:05.737568Z",
"structure_string": "K6 Re2 Cl2 F12\n1.0\n8.173698 0.000000 0.000000\n-0.000000 8.173698 -0.000000\n-0.000000 0.000000 6.010743\nK Re Cl F\n6 2 2 12\ndirect\n0.678751 0.178751 0.500000 K\n0.821249 0.678751 0.500000 K\n0.500000 0.500000 0.000000 K\n0.178751 0.321249 0.500000 K\n0.321249 0.821249 0.500000 K\n0.000000 0.000000 0.000000 K\n0.500000 0.000000 0.000000 Re\n0.000000 0.500000 0.000000 Re\n0.500000 0.500000 0.500000 Cl\n0.000000 0.000000 0.500000 Cl\n0.384458 0.115543 0.245333 F\n0.615543 0.884458 0.245333 F\n0.671845 0.171844 0.000000 F\n0.115543 0.615543 0.245333 F\n0.828156 0.671845 0.000000 F\n0.884458 0.384458 0.245333 F\n0.884458 0.384458 0.754666 F\n0.171844 0.328156 0.000000 F\n0.615543 0.884458 0.754666 F\n0.115543 0.615543 0.754666 F\n0.384458 0.115543 0.754666 F\n0.328156 0.828156 0.000000 F\n",
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{
"id": "jvasp-97595",
"created_at": "2022-09-04T14:36:10.660422Z",
"updated_at": "2022-09-04T14:36:10.660439Z",
"structure_string": "Mg3 V6 Fe4 O24\n1.0\n6.325012 -0.114201 -1.706893\n-2.380235 7.226612 -2.172153\n0.021176 -0.127235 9.662978\nMg V Fe O\n3 6 4 24\ndirect\n0.000000 0.500000 0.500000 Mg\n0.276525 0.291575 0.796954 Mg\n0.723475 0.708425 0.203047 Mg\n0.784319 0.343741 0.734671 V\n0.600789 0.254104 0.130181 V\n0.118287 0.105486 0.337838 V\n0.399211 0.745897 0.869820 V\n0.881713 0.894514 0.662163 V\n0.215681 0.656260 0.265330 V\n0.955881 0.803550 0.987789 Fe\n0.376704 0.962416 0.601435 Fe\n0.623296 0.037584 0.398566 Fe\n0.044118 0.196450 0.012212 Fe\n0.874319 0.983817 0.355719 O\n0.766112 0.188326 0.027746 O\n0.233888 0.811674 0.972255 O\n0.009496 0.718753 0.154100 O\n0.990504 0.281247 0.845901 O\n0.838505 0.669909 0.577831 O\n0.435734 0.875817 0.758631 O\n0.161495 0.330092 0.422170 O\n0.254184 0.516662 0.742214 O\n0.745816 0.483339 0.257787 O\n0.793176 0.290681 0.543917 O\n0.206823 0.709319 0.456084 O\n0.651705 0.959209 0.569821 O\n0.348294 0.040792 0.430180 O\n0.657887 0.763103 0.004568 O\n0.342113 0.236897 0.995433 O\n0.477322 0.776918 0.266406 O\n0.522677 0.223083 0.733595 O\n0.125681 0.016183 0.644282 O\n0.081087 0.056186 0.139475 O\n0.918913 0.943815 0.860526 O\n0.564266 0.124183 0.241370 O\n0.172010 0.428365 0.172154 O\n0.827990 0.571635 0.827847 O\n",
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"formula_full": "Mg3 V6 Fe4 O24",
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{
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"created_at": "2022-09-04T14:36:51.123363Z",
"updated_at": "2022-09-04T14:36:51.123382Z",
"structure_string": "Li2 Ca1 Tl1\n1.0\n-10.492601 0.000000 -6.057906\n-6.821612 -0.045395 -0.300434\n-5.750004 2.985567 -2.156512\nLi Ca Tl\n2 1 1\ndirect\n0.721940 -0.000001 -0.000000 Li\n0.278060 -0.000000 -0.000000 Li\n0.000000 0.000000 0.000000 Ca\n0.500000 -0.000001 -0.000000 Tl\n",
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},
{
"id": "jvasp-118702",
"created_at": "2022-09-04T14:38:28.357953Z",
"updated_at": "2022-09-04T14:38:28.357984Z",
"structure_string": "Mg1 Sb1 O1\n1.0\n3.185271 -0.000000 -0.000000\n-0.000000 3.185271 -0.000000\n-0.000000 0.000000 7.080685\nMg Sb O\n1 1 1\ndirect\n0.000000 0.000000 0.463327 Mg\n0.000000 0.000000 -0.005868 Sb\n0.000000 0.000000 0.722751 O\n",
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"spacegroup": 99
},
{
"id": "jvasp-47387",
"created_at": "2022-09-04T14:38:04.107858Z",
"updated_at": "2022-09-04T14:38:04.107887Z",
"structure_string": "Li4 Mn2 O4 F2\n1.0\n5.022078 0.001696 0.028799\n-2.362550 4.437314 -0.017017\n-1.046657 -1.687182 4.761235\nLi Mn O F\n4 2 4 2\ndirect\n0.411749 0.570453 0.491309 Li\n0.723573 0.259718 0.491202 Li\n0.583312 0.400381 0.990560 Li\n0.234464 0.748381 0.991553 Li\n0.096761 0.885660 0.491280 Mn\n0.902810 0.080493 0.991215 Mn\n0.272334 0.120258 0.256387 O\n0.511068 0.005778 0.743315 O\n0.862339 0.710702 0.726625 O\n0.977030 0.470814 0.238697 O\n0.182855 0.345019 0.745223 F\n0.639302 0.799946 0.238227 F\n",
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{
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"structure_string": "Li4 Ni4 P4 O16\n1.0\n4.251485 -0.000000 0.000000\n-0.000000 4.760196 0.000000\n0.000000 0.000000 14.071309\nLi Ni P O\n4 4 4 16\ndirect\n0.000000 0.250000 0.249588 Li\n0.000000 0.750001 0.750412 Li\n0.499999 0.750001 0.250412 Li\n0.499999 0.250000 0.749588 Li\n0.000000 0.750001 0.063033 Ni\n0.000000 0.250000 0.936967 Ni\n0.499999 0.250000 0.436967 Ni\n0.499999 0.750001 0.563033 Ni\n0.499999 0.250000 0.110501 P\n0.499999 0.750001 0.889499 P\n0.000000 0.250000 0.610501 P\n0.000000 0.750001 0.389499 P\n0.257921 0.587901 0.951516 O\n0.257921 0.087901 0.048484 O\n0.242079 0.587901 0.451516 O\n0.242079 0.087901 0.548484 O\n0.313931 0.966409 0.828672 O\n0.313931 0.466408 0.171328 O\n0.686068 0.533593 0.828672 O\n0.813930 0.033592 0.671328 O\n0.757920 0.412100 0.548484 O\n0.757920 0.912100 0.451516 O\n0.742078 0.912100 0.951516 O\n0.742078 0.412100 0.048484 O\n0.186069 0.966409 0.328672 O\n0.813930 0.533593 0.328672 O\n0.686068 0.033592 0.171328 O\n0.186069 0.466408 0.671328 O\n",
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"structure_string": "K2 Al1 Tl1 Br6\n1.0\n6.848726 -0.000000 3.954114\n2.282909 6.457041 3.954114\n-0.000000 -0.000000 7.908227\nK Al Tl Br\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Tl\n0.775305 0.224696 0.224695 Br\n0.224696 0.224696 0.775304 Br\n0.224696 0.775304 0.775304 Br\n0.224696 0.775304 0.224695 Br\n0.775305 0.224696 0.775304 Br\n0.775305 0.775304 0.224695 Br\n",
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}
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}