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{
"id": "jvasp-103973",
"created_at": "2022-09-04T14:36:39.892846Z",
"updated_at": "2022-09-04T14:36:39.892856Z",
"structure_string": "Cd1 H10 C7 O4\n1.0\n3.769824 -0.515650 -0.261671\n-1.622102 4.388668 -0.152365\n-0.394361 0.008003 11.718275\nCd H C O\n1 10 7 4\ndirect\n0.184325 0.005358 0.195810 Cd\n0.842935 0.189188 0.585880 H\n0.947393 0.240796 0.807147 H\n0.461239 0.385085 0.805519 H\n0.495040 0.852054 0.694469 H\n0.980804 0.708308 0.696057 H\n0.078666 0.758293 0.915652 H\n0.589002 0.917919 0.912375 H\n0.878017 0.662657 0.475941 H\n0.388775 0.806502 0.474634 H\n0.357205 0.334219 0.584153 H\n0.034324 0.384554 0.365285 C\n0.105775 0.582323 0.477101 C\n0.127241 0.412679 0.585589 C\n0.210699 0.628464 0.695316 C\n0.230576 0.463734 0.805512 C\n0.314932 0.686833 0.912890 C\n0.355420 0.551133 0.026825 C\n0.251817 0.253077 0.028766 O\n-0.100250 0.453974 0.271317 O\n0.119778 0.151166 0.369425 O\n0.499828 0.750022 0.118179 O\n",
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{
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"structure_string": "Na1 Co2 Bi1 O6\n1.0\n4.489560 -0.123719 2.721682\n1.472231 4.243111 2.721682\n-0.179052 -0.123719 5.247060\nNa Co Bi O\n1 2 1 6\ndirect\n0.268175 0.268175 0.268175 Na\n0.009132 0.009132 0.009132 Co\n0.510981 0.510981 0.510981 Co\n0.776874 0.776873 0.776873 Bi\n0.176448 0.745950 0.332949 O\n0.332950 0.176448 0.745950 O\n0.745950 0.332949 0.176448 O\n0.234572 0.673344 0.837376 O\n0.673344 0.837376 0.234571 O\n0.837376 0.234571 0.673344 O\n",
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{
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"created_at": "2022-09-04T14:36:37.711103Z",
"updated_at": "2022-09-04T14:36:37.711123Z",
"structure_string": "Ba2 Zn1 Re1 O6\n1.0\n5.011447 0.000063 2.893390\n1.670472 4.724789 2.893510\n-0.000003 0.000146 5.786785\nBa Zn Re O\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Ba\n0.250001 0.250000 0.250001 Ba\n0.000000 -0.000000 0.000000 Zn\n0.500001 0.500000 0.500000 Re\n0.261618 0.738383 0.261621 O\n0.261622 0.261622 0.738381 O\n0.738383 0.261623 0.261619 O\n0.738378 0.738379 0.261618 O\n0.261618 0.738378 0.738381 O\n0.738382 0.261618 0.738379 O\n",
"nsites": 10,
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{
"id": "jvasp-105655",
"created_at": "2022-09-04T14:36:14.140544Z",
"updated_at": "2022-09-04T14:36:14.140578Z",
"structure_string": "Rb2 Cu1 As1 F6\n1.0\n5.258147 0.000000 3.035792\n1.752716 4.957428 3.035792\n0.000000 0.000000 6.071585\nRb Cu As F\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 As\n0.756014 0.243987 0.243986 F\n0.243987 0.243987 0.756014 F\n0.243987 0.756014 0.756013 F\n0.243987 0.756014 0.243986 F\n0.756014 0.243987 0.756013 F\n0.756014 0.756014 0.243986 F\n",
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"volume": 158.2673089700981,
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{
"id": "jvasp-48884",
"created_at": "2022-09-04T14:36:19.566957Z",
"updated_at": "2022-09-04T14:36:19.566985Z",
"structure_string": "Li2 Cr2 C4 O12\n1.0\n0.000000 4.800337 0.162094\n7.784967 0.000000 0.000000\n0.000000 -2.489197 -6.011858\nLi Cr C O\n2 2 4 12\ndirect\n0.515561 0.952258 0.359515 Li\n0.484440 0.452258 0.640486 Li\n0.259034 0.994904 0.759107 Cr\n0.740966 0.494904 0.240894 Cr\n0.526907 0.735698 0.892118 C\n0.473094 0.235698 0.107883 C\n0.040986 0.753427 0.399441 C\n0.959014 0.253427 0.600560 C\n0.748725 0.746409 0.346310 O\n0.251276 0.246409 0.653691 O\n0.192963 0.895189 0.456154 O\n0.165732 0.608882 0.385677 O\n0.336674 0.372862 0.127690 O\n0.657657 0.585847 0.936510 O\n0.240669 0.755669 0.853834 O\n0.759332 0.255669 0.146167 O\n0.807038 0.395189 0.543847 O\n0.663326 0.872862 0.872311 O\n0.342344 0.085846 0.063491 O\n0.834268 0.108881 0.614324 O\n",
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{
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"created_at": "2022-09-04T14:36:37.116281Z",
"updated_at": "2022-09-04T14:36:37.116321Z",
"structure_string": "K1 Na1 Mg2 F6\n1.0\n4.847231 -0.000000 2.798550\n1.615744 4.570013 2.798550\n-0.000000 -0.000000 5.597100\nK Na Mg F\n1 1 2 6\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Na\n0.250000 0.250000 0.250000 Mg\n0.749999 0.749999 0.750000 Mg\n0.500000 0.500000 0.000000 F\n0.000000 0.000000 0.500000 F\n0.500000 0.000000 0.500000 F\n-0.000000 0.500000 0.000000 F\n-0.000000 0.500000 0.500000 F\n0.500000 0.000000 0.000000 F\n",
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"volume": 123.9864480952332,
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{
"id": "jvasp-107864",
"created_at": "2022-09-04T14:36:37.102183Z",
"updated_at": "2022-09-04T14:36:37.102204Z",
"structure_string": "Rb2 Li1 Ta1 Br6\n1.0\n6.509933 -0.000000 3.758512\n2.169978 6.137624 3.758512\n-0.000000 -0.000000 7.517023\nRb Li Ta Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Ta\n0.752639 0.247360 0.247360 Br\n0.247360 0.247360 0.752639 Br\n0.247361 0.752639 0.752639 Br\n0.247361 0.752639 0.247360 Br\n0.752639 0.247360 0.752639 Br\n0.752640 0.752639 0.247360 Br\n",
"nsites": 10,
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],
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{
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"created_at": "2022-09-04T14:36:36.513122Z",
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"structure_string": "Rb2 Al1 Hg1 F6\n1.0\n5.374775 -0.000000 3.103127\n1.791592 5.067386 3.103127\n0.000000 0.000000 6.206256\nRb Al Hg F\n2 1 1 6\ndirect\n0.749999 0.750001 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Al\n0.499999 0.500000 0.500001 Hg\n0.791116 0.208884 0.208884 F\n0.208883 0.208884 0.791117 F\n0.208883 0.791117 0.791118 F\n0.208883 0.791117 0.208884 F\n0.791116 0.208884 0.791118 F\n0.791115 0.791117 0.208885 F\n",
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{
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"created_at": "2022-09-04T14:36:22.326165Z",
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"structure_string": "Ca2 Ir1 Pt1 O6\n1.0\n5.180271 -0.005584 0.012277\n4.197246 3.036177 0.012277\n-0.009388 -0.003034 7.372185\nCa Ir Pt O\n2 1 1 6\ndirect\n0.750914 0.750917 0.253258 Ca\n0.249084 0.249087 0.746742 Ca\n-0.000001 0.000001 0.500000 Ir\n0.000000 0.000000 0.000000 Pt\n0.370321 0.370322 0.045939 O\n0.629677 0.629681 0.954061 O\n0.375526 0.375528 0.447586 O\n0.624472 0.624475 0.552414 O\n0.082861 0.082862 0.252284 O\n0.917136 0.917141 0.747716 O\n",
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{
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"structure_string": "Ba2 Mn2 As2 O1\n1.0\n4.190207 0.001125 0.002342\n2.095251 6.046475 -0.060419\n2.089871 2.009145 6.331273\nBa Mn As O\n2 2 2 1\ndirect\n0.949312 0.808040 0.293618 Ba\n0.049986 0.194276 0.706386 Ba\n0.690626 0.696740 0.922296 Mn\n0.308671 0.305566 0.077713 Mn\n0.312628 0.641009 0.734016 As\n0.686664 0.361303 0.265994 As\n0.499646 0.001156 0.000006 O\n",
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]
}