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{
"id": "jvasp-112089",
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{
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{
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"updated_at": "2022-09-04T14:36:39.107176Z",
"structure_string": "Ti4 O3\n1.0\n3.872825 -0.014825 -3.358291\n-0.816449 3.785816 -3.358291\n0.012016 0.014825 5.126086\nTi O\n4 3\ndirect\n0.000001 0.500001 0.500002 Ti\n0.266279 0.266278 0.000000 Ti\n0.500001 -0.000000 0.500001 Ti\n0.733722 0.733721 0.000001 Ti\n0.750001 0.250000 0.500002 O\n0.000000 0.000000 0.000000 O\n0.250001 0.750001 0.500002 O\n",
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{
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"updated_at": "2022-09-04T14:36:14.207867Z",
"structure_string": "Ce1 Al1 O3\n1.0\n3.777759 0.000000 0.000000\n0.000000 3.777759 -0.000000\n0.000000 -0.000000 3.777741\nCe Al O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Ce\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n",
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},
{
"id": "jvasp-116813",
"created_at": "2022-09-04T14:38:43.766370Z",
"updated_at": "2022-09-04T14:38:43.766402Z",
"structure_string": "V6 O7 F5\n1.0\n4.630895 -0.018076 0.042224\n0.077177 5.508693 0.399817\n-0.000902 0.075534 7.612724\nV O F\n6 7 5\ndirect\n0.521145 0.167508 0.333954 V\n0.463312 0.478021 0.982177 V\n0.529764 0.819745 0.663608 V\n0.996995 0.685200 0.320222 V\n0.963713 0.343055 0.676594 V\n0.015314 0.008015 0.023073 V\n0.205269 0.699273 0.096532 O\n0.302127 0.203979 0.107180 O\n0.295995 0.529850 0.760959 O\n0.801566 0.975339 0.237476 O\n0.797079 0.289900 0.905121 O\n0.807008 0.630262 0.556102 O\n0.694013 0.130034 0.570049 O\n0.200924 0.028401 0.772883 F\n0.709751 0.793322 0.902320 F\n0.698351 0.475652 0.226232 F\n0.302306 0.871188 0.434730 F\n0.195372 0.371238 0.430780 F\n",
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{
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"created_at": "2022-09-04T14:38:29.310684Z",
"updated_at": "2022-09-04T14:38:29.310709Z",
"structure_string": "Li2 Cu4 P2 O8\n1.0\n0.000000 5.396386 0.144967\n5.076514 0.000000 0.000000\n0.000000 -0.297253 -6.304874\nLi Cu P O\n2 4 2 8\ndirect\n0.328952 0.011720 0.494200 Li\n0.671049 0.511719 0.505799 Li\n0.221407 0.488978 0.764099 Cu\n0.778595 0.988978 0.235900 Cu\n0.619111 0.438483 0.993745 Cu\n0.380890 0.938483 0.006254 Cu\n0.844512 0.009087 0.731962 P\n0.155490 0.509087 0.268037 P\n0.118702 0.923769 0.721591 O\n0.822540 0.314148 0.746928 O\n0.684075 0.906572 0.532069 O\n0.315927 0.406572 0.467930 O\n0.177462 0.814148 0.253071 O\n0.881299 0.423769 0.278408 O\n0.263070 0.378538 0.070307 O\n0.736932 0.878538 0.929692 O\n",
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{
"id": "jvasp-103854",
"created_at": "2022-09-04T14:36:59.112503Z",
"updated_at": "2022-09-04T14:36:59.112537Z",
"structure_string": "H6 C10 S2 N2 O4\n1.0\n3.794430 -0.071029 0.057145\n-1.985407 7.350584 -2.106065\n0.349448 -0.117063 9.360560\nH C S N O\n6 10 2 2 4\ndirect\n0.793105 0.860960 0.321854 H\n0.793144 0.361010 0.821765 H\n0.110414 0.062832 0.144576 H\n0.111503 0.562647 0.644452 H\n0.738737 0.024464 0.853435 H\n0.737703 0.524577 0.353402 H\n0.780430 0.369274 0.140255 C\n0.780988 0.869138 0.640254 C\n0.139946 0.568108 0.001148 C\n0.140543 0.067921 0.501125 C\n0.427358 0.757038 0.835903 C\n0.008896 0.487789 0.857176 C\n0.008913 0.987721 0.357220 C\n0.175652 0.598379 0.762436 C\n0.175115 0.098436 0.262502 C\n0.426996 0.257055 0.335906 C\n0.469075 0.275119 0.523962 S\n0.468546 0.775299 0.024038 S\n0.654642 0.895248 0.781225 N\n0.653848 0.395344 0.281194 N\n0.696453 0.729425 0.535167 O\n0.030850 0.031729 0.634748 O\n0.029655 0.532043 0.134758 O\n0.696545 0.229501 0.035198 O\n",
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{
"id": "jvasp-112698",
"created_at": "2022-09-04T14:38:41.774240Z",
"updated_at": "2022-09-04T14:38:41.774269Z",
"structure_string": "Ca3 Mg2 Fe1 C6 O18\n1.0\n4.845328 -0.003600 -0.007498\n-2.420066 5.386620 -1.022657\n0.015407 0.058882 12.384681\nCa Mg Fe C O\n3 2 1 6 18\ndirect\n0.661167 0.831896 0.831559 Ca\n0.338830 0.168103 0.168437 Ca\n-0.000002 0.500000 0.499998 Ca\n0.666590 0.834122 0.333586 Mg\n0.333407 0.165878 0.666410 Mg\n-0.000002 0.500000 -0.000002 Fe\n0.009560 0.518664 0.248927 C\n0.340610 0.184707 0.913633 C\n0.676980 0.851474 0.580794 C\n0.323018 0.148526 0.419202 C\n0.659387 0.815292 0.086363 C\n0.990437 0.481336 0.751069 C\n0.209181 0.601512 0.332091 O\n0.749290 0.530041 0.259742 O\n0.066753 0.415011 0.155947 O\n0.408806 0.094179 0.820151 O\n0.735080 0.754966 0.486556 O\n0.532885 0.264911 0.999113 O\n0.876336 0.930859 0.663853 O\n0.924961 0.812140 0.077236 O\n0.467113 0.735087 0.000883 O\n0.585006 0.140336 0.406846 O\n0.933244 0.584989 0.844050 O\n0.264917 0.245034 0.513440 O\n0.591192 0.905821 0.179846 O\n0.414992 0.859665 0.593150 O\n0.790816 0.398489 0.667906 O\n0.123661 0.069141 0.336144 O\n0.250708 0.469959 0.740254 O\n0.075036 0.187860 0.922760 O\n",
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{
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"created_at": "2022-09-04T14:36:56.593402Z",
"updated_at": "2022-09-04T14:36:56.593421Z",
"structure_string": "Al4 Cd2 O8\n1.0\n5.976278 -0.000000 -0.000000\n2.988139 5.175608 0.000000\n2.988139 1.725202 4.879609\nAl Cd O\n4 2 8\ndirect\n0.125000 0.625000 0.625000 Al\n0.625000 0.125000 0.625000 Al\n0.625000 0.625000 0.125000 Al\n0.625000 0.625000 0.625000 Al\n0.000000 0.000000 0.000000 Cd\n0.250000 0.250000 0.250000 Cd\n0.395350 0.395350 0.395350 O\n0.395350 0.395350 0.813951 O\n0.395350 0.813951 0.395350 O\n0.813952 0.395350 0.395350 O\n0.436049 0.854650 0.854650 O\n0.854651 0.436048 0.854650 O\n0.854651 0.854650 0.436049 O\n0.854651 0.854650 0.854650 O\n",
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{
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"created_at": "2022-09-04T14:38:44.692227Z",
"updated_at": "2022-09-04T14:38:44.692244Z",
"structure_string": "Li6 V2 O2 F10\n1.0\n5.053421 -0.124686 -0.223730\n-1.726938 5.341254 0.396744\n-0.151829 0.353622 8.079555\nLi V O F\n6 2 2 10\ndirect\n0.059079 0.919020 0.652684 Li\n0.559082 0.419017 0.152687 Li\n-0.010258 0.389059 0.688208 Li\n0.489748 0.889060 0.188208 Li\n0.484986 0.745627 0.826939 Li\n-0.015013 0.245631 0.326939 Li\n0.522822 0.567041 0.499619 V\n0.022820 0.067037 -0.000381 V\n0.217409 0.072324 0.172574 O\n0.717400 0.572322 0.672575 O\n0.707380 0.751150 0.041950 F\n0.802413 0.054285 0.773581 F\n0.302414 0.554286 0.273579 F\n0.771066 0.214631 0.090579 F\n0.271055 0.714634 0.590577 F\n0.220921 0.905740 0.877110 F\n0.720922 0.405738 0.377112 F\n0.729785 0.896321 0.392547 F\n0.229785 0.396327 0.892545 F\n0.207378 0.251155 0.541951 F\n",
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{
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"created_at": "2022-09-04T14:38:50.435128Z",
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"structure_string": "Li2 Mn2 F8\n1.0\n5.176212 -0.007004 -1.918553\n-2.466885 4.531057 -1.964195\n-0.014521 0.007004 5.520308\nLi Mn F\n2 2 8\ndirect\n0.000062 0.750000 0.250062 Li\n-0.000063 0.249999 0.749937 Li\n0.500000 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.695681 0.945719 0.749962 F\n0.304243 0.554282 0.749962 F\n0.209532 0.000027 0.709560 F\n0.790468 -0.000027 0.290441 F\n0.209532 0.499973 0.209505 F\n0.790467 0.500028 0.790495 F\n0.304318 0.054282 0.250038 F\n0.695756 0.445719 0.250038 F\n",
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{
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"created_at": "2022-09-04T14:37:55.643146Z",
"updated_at": "2022-09-04T14:37:55.643161Z",
"structure_string": "Cr2 O4\n1.0\n-1.267430 -2.473929 0.826417\n3.838268 2.346868 7.837910\n-1.512020 2.473974 0.000241\nCr O\n2 4\ndirect\n0.503086 0.749796 0.246301 Cr\n0.504830 0.249733 0.748205 Cr\n0.767520 0.143418 0.379581 O\n0.765797 0.643478 0.877725 O\n0.242110 0.356055 0.116795 O\n0.240396 0.856111 0.614901 O\n",
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}
]
}