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{
"id": "jvasp-113969",
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"structure_string": "Mg1 B1 C1\n1.0\n3.685454 0.000000 -0.000000\n-1.842727 3.191697 0.000000\n0.000000 0.000000 3.823613\nMg B C\n1 1 1\ndirect\n0.666666 0.333334 0.000000 Mg\n0.000000 0.000000 0.000000 B\n0.333333 0.666668 0.000000 C\n",
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{
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{
"id": "jvasp-80548",
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"structure_string": "K2 Na1 Cd1\n1.0\n-17.905839 -0.000000 -10.337941\n-10.499903 -0.537389 -2.489516\n-9.215253 3.096150 -4.714596\nK Na Cd\n2 1 1\ndirect\n0.664954 0.000000 0.000000 K\n0.335046 0.000000 0.000000 K\n0.000000 0.000000 0.000000 Na\n0.500000 0.000000 0.000000 Cd\n",
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{
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"created_at": "2022-09-04T14:38:04.720963Z",
"updated_at": "2022-09-04T14:38:04.720989Z",
"structure_string": "Ca1 Mg3\n1.0\n6.499989 -1.741769 0.000000\n-2.379205 4.120905 0.000000\n0.000000 0.000000 4.764682\nCa Mg\n1 3\ndirect\n0.249985 0.749985 0.250000 Ca\n0.750011 0.750011 0.250000 Mg\n0.249994 0.249994 0.750000 Mg\n0.750005 0.250005 0.750000 Mg\n",
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{
"id": "jvasp-118718",
"created_at": "2022-09-04T14:38:53.563354Z",
"updated_at": "2022-09-04T14:38:53.563382Z",
"structure_string": "Sr1 Mg1 O1\n1.0\n4.040691 0.000000 0.000000\n0.000000 4.040691 -0.000000\n-0.000000 0.000000 7.481078\nSr Mg O\n1 1 1\ndirect\n0.000000 0.000000 0.081159 Sr\n0.000000 0.000000 0.557715 Mg\n0.000000 0.000000 0.801103 O\n",
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{
"id": "jvasp-104162",
"created_at": "2022-09-04T14:36:55.764179Z",
"updated_at": "2022-09-04T14:36:55.764197Z",
"structure_string": "H4 C6 S4 O2\n1.0\n4.572835 0.069617 0.197336\n0.399750 4.365272 0.403492\n0.134288 0.327906 11.358341\nH C S O\n4 6 4 2\ndirect\n0.280102 0.197369 0.865942 H\n0.780116 0.197376 0.365941 H\n0.531540 0.335758 0.753147 H\n0.031549 0.335766 0.253145 H\n0.152162 0.653308 0.784805 C\n0.652173 0.653315 0.284805 C\n0.662900 0.167757 0.189016 C\n0.162891 0.167750 0.689016 C\n0.295166 0.331399 0.778250 C\n0.795176 0.331406 0.278248 C\n0.455431 0.310634 0.082292 S\n0.955425 0.310628 0.582292 S\n0.888568 0.750285 0.880350 S\n0.388579 0.750290 0.380350 S\n0.272333 0.851131 0.699490 O\n0.772342 0.851139 0.199489 O\n",
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"formula_full": "H4 C6 S4 O2",
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{
"id": "jvasp-112047",
"created_at": "2022-09-04T14:38:42.089327Z",
"updated_at": "2022-09-04T14:38:42.089356Z",
"structure_string": "Ca2 H24 C16 O8\n1.0\n4.194802 -0.012818 0.104684\n0.368520 7.945648 0.937100\n0.059072 0.097604 12.175074\nCa H C O\n2 24 16 8\ndirect\n0.924373 0.495091 0.840984 Ca\n0.924373 -0.004908 0.840983 Ca\n0.816470 0.349115 0.463225 H\n0.818057 0.136285 0.521200 H\n0.818046 0.636285 0.521198 H\n0.267464 0.181780 0.602611 H\n0.267457 0.681780 0.602612 H\n0.265156 0.895617 0.549311 H\n0.265165 0.395617 0.549310 H\n0.322287 0.301055 0.355760 H\n0.322273 0.801055 0.355759 H\n0.348597 0.087948 0.411348 H\n0.348577 0.587949 0.411348 H\n0.816457 0.849114 0.463222 H\n0.861189 0.769662 0.262148 H\n0.861198 0.269667 0.262147 H\n0.447891 0.836988 0.115430 H\n0.149336 0.689661 0.110256 H\n0.149343 0.189646 0.110259 H\n0.416828 0.487772 0.231345 H\n0.447883 0.336983 0.115432 H\n0.776977 0.015423 0.155904 H\n0.776956 0.515423 0.155904 H\n0.905644 0.563645 0.330062 H\n0.905667 0.063652 0.330061 H\n0.416854 0.987769 0.231349 H\n0.493150 0.198265 0.386061 C\n0.406343 0.206271 0.106277 C\n0.406337 0.706277 0.106275 C\n0.582402 0.083768 0.196514 C\n0.582382 0.583769 0.196512 C\n0.727160 0.157803 0.293243 C\n0.727142 0.657800 0.293243 C\n0.493134 0.698265 0.386062 C\n0.423702 0.287378 0.578782 C\n0.660375 0.743300 0.487920 C\n0.423694 0.787378 0.578781 C\n0.534295 0.174901 0.992748 C\n0.534289 0.674903 0.992748 C\n0.567620 0.322590 0.685758 C\n0.567614 0.822590 0.685757 C\n0.660388 0.243299 0.487920 C\n0.426854 0.930350 0.741913 O\n0.828427 0.745655 0.717938 O\n0.828432 0.245655 0.717939 O\n0.403694 0.570725 0.938606 O\n0.403698 0.070727 0.938605 O\n0.793597 0.744098 0.957268 O\n0.793603 0.244098 0.957270 O\n0.426854 0.430350 0.741914 O\n",
"nsites": 50,
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"formula_full": "Ca2 H24 C16 O8",
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{
"id": "jvasp-12578",
"created_at": "2022-09-04T14:37:11.639229Z",
"updated_at": "2022-09-04T14:37:11.639254Z",
"structure_string": "K2 Li4 H6 O6\n1.0\n0.000000 5.127244 -0.214047\n5.553222 0.000000 0.000000\n0.000000 -0.419879 -6.962547\nK Li H O\n2 4 6 6\ndirect\n0.778693 0.250000 0.499522 K\n0.221307 0.750000 0.500479 K\n0.637233 0.549066 0.134627 Li\n0.637233 0.950933 0.134627 Li\n0.362766 0.450933 0.865374 Li\n0.362766 0.049067 0.865374 Li\n0.787947 0.250000 0.936450 H\n0.212052 0.750000 0.063551 H\n0.833741 0.750000 0.805239 H\n0.166258 0.250000 0.194762 H\n0.776048 0.750000 0.704345 H\n0.223952 0.250000 0.295656 H\n0.907945 0.750000 0.208075 O\n0.092054 0.250000 0.791926 O\n0.700849 0.750000 0.365568 O\n0.375522 0.750000 0.991508 O\n0.299150 0.250000 0.634433 O\n0.624477 0.250000 0.008493 O\n",
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"volume": 198.74176970970683,
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"formula_full": "K2 Li4 H6 O6",
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{
"id": "jvasp-20944",
"created_at": "2022-09-04T14:38:29.932255Z",
"updated_at": "2022-09-04T14:38:29.932279Z",
"structure_string": "K28 Li4 Si32\n1.0\n12.454053 0.000000 -0.000000\n0.000000 12.454053 0.000000\n-0.000000 0.000000 12.454053\nK Li Si\n28 4 32\ndirect\n0.274068 0.811023 0.043875 K\n0.688976 0.956125 0.774068 K\n0.774068 0.688976 0.956125 K\n0.956125 0.774068 0.688976 K\n0.000000 0.500000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.500000 0.000000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.188977 0.956125 0.725932 K\n0.688976 0.543875 0.274068 K\n0.811023 0.456125 0.774068 K\n0.543875 0.274068 0.688976 K\n0.774068 0.811023 0.456125 K\n0.725932 0.188977 0.956125 K\n0.274068 0.688976 0.543875 K\n0.543875 0.225932 0.188977 K\n0.456125 0.774068 0.811023 K\n0.043875 0.225932 0.311023 K\n0.225932 0.311023 0.043875 K\n0.311023 0.043875 0.225932 K\n0.811023 0.043875 0.274068 K\n0.311023 0.456125 0.725932 K\n0.188977 0.543875 0.225932 K\n0.456125 0.725932 0.311023 K\n0.225932 0.188977 0.543875 K\n0.725932 0.311023 0.456125 K\n0.043875 0.274068 0.811023 K\n0.956125 0.725932 0.188977 K\n0.500000 0.000000 0.000000 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.500000 Li\n0.051864 0.700074 0.932802 Si\n0.303178 0.196822 0.803178 Si\n0.196822 0.803178 0.303178 Si\n0.803178 0.303178 0.196822 Si\n0.696822 0.696822 0.696822 Si\n0.696822 0.803178 0.196822 Si\n0.700074 0.567198 0.551864 Si\n0.196822 0.696822 0.803178 Si\n0.303178 0.303178 0.303178 Si\n0.432802 0.051864 0.799926 Si\n0.932802 0.448136 0.200074 Si\n0.567198 0.551864 0.700074 Si\n0.448136 0.200074 0.932802 Si\n0.700074 0.932802 0.051864 Si\n0.803178 0.196822 0.696822 Si\n0.200074 0.932802 0.448136 Si\n0.799926 0.432802 0.051864 Si\n0.551864 0.700074 0.567198 Si\n0.948136 0.299926 0.067198 Si\n0.299926 0.067198 0.948136 Si\n0.067198 0.948136 0.299926 Si\n0.567198 0.948136 0.200074 Si\n0.067198 0.551864 0.799926 Si\n0.432802 0.448136 0.299926 Si\n0.551864 0.799926 0.067198 Si\n0.299926 0.432802 0.448136 Si\n0.799926 0.067198 0.551864 Si\n0.948136 0.200074 0.567198 Si\n0.200074 0.567198 0.948136 Si\n0.051864 0.799926 0.432802 Si\n0.448136 0.299926 0.432802 Si\n0.932802 0.051864 0.700074 Si\n",
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{
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{
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{
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]
}