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{
"id": "jvasp-95414",
"created_at": "2022-09-04T14:35:57.484575Z",
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"structure_string": "Ca4 V8 O16\n1.0\n2.976161 -0.000000 0.000000\n0.000000 9.270674 0.000000\n0.000000 0.000000 10.767541\nCa V O\n4 8 16\ndirect\n0.250000 0.242060 0.345147 Ca\n0.250000 0.742060 0.154853 Ca\n0.750000 0.257940 0.845147 Ca\n0.750000 0.757940 0.654853 Ca\n0.250000 0.583438 0.894667 V\n0.750000 0.416562 0.105333 V\n0.750000 0.936403 0.886485 V\n0.750000 0.916562 0.394667 V\n0.250000 0.563596 0.386485 V\n0.750000 0.436404 0.613515 V\n0.250000 0.063596 0.113515 V\n0.250000 0.083438 0.605333 V\n0.750000 0.523747 0.783385 O\n0.250000 0.083038 0.926906 O\n0.750000 0.916961 0.073094 O\n0.250000 0.976252 0.283385 O\n0.750000 0.023747 0.716615 O\n0.250000 0.476253 0.216615 O\n0.250000 0.883205 0.523566 O\n0.250000 0.293224 0.664503 O\n0.250000 0.383205 0.976434 O\n0.750000 0.616795 0.023566 O\n0.250000 0.793224 0.835497 O\n0.750000 0.206776 0.164503 O\n0.750000 0.416962 0.426906 O\n0.750000 0.706776 0.335497 O\n0.750000 0.116795 0.476434 O\n0.250000 0.583038 0.573094 O\n",
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{
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{
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"updated_at": "2022-09-04T14:38:41.676641Z",
"structure_string": "Lu4 Be4 Ge2 O14\n1.0\n7.321962 0.000000 -0.000000\n0.000000 7.321962 0.000000\n0.000000 -0.000000 4.750304\nLu Be Ge O\n4 4 2 14\ndirect\n0.157198 0.342802 0.506959 Lu\n0.842801 0.657198 0.506959 Lu\n0.657198 0.157198 0.493040 Lu\n0.342802 0.842801 0.493040 Lu\n0.636347 0.863652 0.947146 Be\n0.363653 0.136347 0.947146 Be\n0.136347 0.636347 0.052853 Be\n0.863652 0.363653 0.052853 Be\n0.000000 0.000000 0.000000 Ge\n0.500000 0.500000 0.000000 Ge\n0.583734 0.670494 0.773725 O\n0.829505 0.916266 0.773725 O\n0.416266 0.329505 0.773725 O\n0.170495 0.083734 0.773725 O\n0.916266 0.170495 0.226274 O\n0.083734 0.829505 0.226274 O\n0.500000 0.000000 0.804333 O\n0.142530 0.642529 0.718052 O\n0.357470 0.142530 0.281947 O\n0.642529 0.857470 0.281947 O\n0.329505 0.583734 0.226274 O\n0.000000 0.500000 0.195667 O\n0.857470 0.357470 0.718052 O\n0.670494 0.416266 0.226274 O\n",
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"formula_full": "Lu4 Be4 Ge2 O14",
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{
"id": "jvasp-59884",
"created_at": "2022-09-04T14:38:18.835415Z",
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"structure_string": "Mg2 Ti4 O8\n1.0\n5.868027 0.000521 0.000757\n2.933606 5.159890 -0.000676\n2.933257 1.595586 4.907124\nMg Ti O\n2 4 8\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 -0.000000 0.000000 Mg\n0.000000 0.500000 -0.000000 Ti\n0.000001 0.500001 0.499999 Ti\n0.000000 0.000001 0.500000 Ti\n0.500001 0.500001 0.500000 Ti\n0.771006 0.252665 0.252663 O\n0.756614 0.746911 0.239862 O\n0.223667 0.252665 0.252662 O\n0.243387 0.760137 0.253092 O\n0.776335 0.747336 0.747337 O\n0.243388 0.253090 0.760137 O\n0.756615 0.239864 0.746907 O\n0.228996 0.747336 0.747336 O\n",
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{
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"updated_at": "2022-09-04T14:38:00.733500Z",
"structure_string": "Li4 V2 F12\n1.0\n0.000000 4.400132 -0.752805\n8.609404 0.000000 0.000000\n0.000000 -0.843999 -4.898056\nLi V F\n4 2 12\ndirect\n0.000068 0.667291 0.750010 Li\n0.500177 0.333940 0.750100 Li\n0.499823 0.833939 0.249902 Li\n-0.000068 0.167292 0.249991 Li\n0.499946 0.000616 0.749908 V\n0.500053 0.500616 0.250094 V\n0.733865 0.157144 0.596002 F\n0.733887 0.657135 0.096120 F\n0.733967 -0.000652 0.061984 F\n0.733932 0.345266 0.092442 F\n0.266135 0.657144 0.404000 F\n0.266068 0.845266 0.907560 F\n0.266196 0.345298 0.407743 F\n0.734107 0.499390 0.562167 F\n0.266033 0.499348 0.938018 F\n0.266113 0.157135 0.903881 F\n0.265893 -0.000610 0.437835 F\n0.733804 0.845298 0.592259 F\n",
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{
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"created_at": "2022-09-04T14:38:52.318603Z",
"updated_at": "2022-09-04T14:38:52.318620Z",
"structure_string": "Mn1 Ge1 O4\n1.0\n-1.864730 1.864730 4.578055\n1.864730 -1.864730 4.578055\n1.864730 1.864730 -4.578055\nMn Ge O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Mn\n0.749999 0.250000 0.499999 Ge\n0.956788 0.456788 0.499999 O\n0.793562 0.793562 0.000000 O\n0.543211 0.043212 0.499999 O\n0.206439 0.206439 0.000000 O\n",
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{
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"created_at": "2022-09-04T14:36:55.201463Z",
"updated_at": "2022-09-04T14:36:55.201483Z",
"structure_string": "Be1 Zn3 O4\n1.0\n4.016016 -0.014638 -3.545254\n-0.826805 3.930012 -3.545254\n0.011923 0.014638 5.356964\nBe Zn O\n1 3 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Zn\n0.249999 0.750000 0.499999 Zn\n0.750000 0.250000 0.500000 Zn\n0.670344 0.670344 0.563005 O\n0.107338 0.107338 0.436994 O\n0.892662 0.329655 0.000001 O\n0.329654 0.892661 -0.000000 O\n",
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{
"id": "jvasp-14264",
"created_at": "2022-09-04T14:37:04.104186Z",
"updated_at": "2022-09-04T14:37:04.104218Z",
"structure_string": "Ta4 Sn2 O14\n1.0\n4.767783 -0.000000 -1.353283\n0.070904 5.182742 0.249804\n-0.119912 0.553954 8.652923\nTa Sn O\n4 2 14\ndirect\n0.610036 0.803557 0.675493 Ta\n0.065457 0.303557 0.675493 Ta\n0.389963 0.196442 0.324506 Ta\n0.934542 0.696442 0.324506 Ta\n0.769956 0.250000 0.000000 Sn\n0.230042 0.750000 -0.000000 Sn\n0.691049 0.996798 0.282780 O\n0.408270 0.503201 0.717220 O\n0.905455 0.027845 0.838314 O\n0.067141 0.472154 0.161686 O\n0.682976 0.164860 0.551889 O\n0.622773 0.750000 -0.000000 O\n0.377226 0.250000 -0.000000 O\n0.591729 0.496798 0.282780 O\n0.308950 0.003201 0.717220 O\n0.868912 0.664860 0.551889 O\n0.317023 0.835139 0.448110 O\n0.131087 0.335139 0.448110 O\n0.932858 0.527845 0.838313 O\n0.094544 0.972154 0.161686 O\n",
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{
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"updated_at": "2022-09-04T14:38:47.854007Z",
"structure_string": "Li1 V6 O7 F5\n1.0\n5.259655 0.002085 1.770581\n1.163169 5.212412 1.866833\n0.010886 0.067493 7.378759\nLi V O F\n1 6 7 5\ndirect\n0.985661 0.483027 0.524672 Li\n0.644418 0.684592 0.849250 V\n0.399409 0.317040 0.698960 V\n0.632874 0.676148 0.323276 V\n-0.000865 0.021424 0.486101 V\n0.290352 0.318621 0.162190 V\n0.013120 0.970334 0.995453 V\n0.297068 0.678646 -0.002267 O\n0.753672 0.773928 0.036108 O\n0.937059 0.372231 0.325075 O\n0.651547 0.023103 0.669214 O\n0.605793 0.557030 0.633631 O\n0.234210 0.210612 0.966987 O\n0.357044 0.968472 0.336925 O\n0.383874 0.441274 0.381974 F\n0.056911 0.639940 0.675505 F\n0.095344 0.133367 0.688083 F\n0.909070 0.871829 0.304789 F\n0.693375 0.291453 0.016725 F\n",
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{
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"created_at": "2022-09-04T14:36:07.927024Z",
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"structure_string": "Na1 Cr4 O8\n1.0\n0.000000 2.943369 -0.000000\n-6.848265 1.471684 0.023745\n0.020199 -1.471684 6.845035\nNa Cr O\n1 4 8\ndirect\n0.500000 0.000000 0.000000 Na\n0.349857 0.816994 0.516710 Cr\n0.833108 0.516854 0.183069 Cr\n0.166893 0.483145 0.816931 Cr\n0.650143 0.183005 0.483290 Cr\n0.849110 0.954399 0.652620 O\n0.838185 0.704695 0.381066 O\n0.196392 0.652560 0.045345 O\n0.542860 0.618607 0.704325 O\n0.457141 0.381392 0.295675 O\n0.803609 0.347439 0.954655 O\n0.161816 0.295304 0.618934 O\n0.150891 0.045600 0.347380 O\n",
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],
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"volume": 137.97658305134217,
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"formula_full": "Na1 Cr4 O8",
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"formula_anonymous": "AB4C8",
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"spacegroup": 87
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{
"id": "jvasp-111549",
"created_at": "2022-09-04T14:38:41.706036Z",
"updated_at": "2022-09-04T14:38:41.706065Z",
"structure_string": "Mn4 Ru4 N8\n1.0\n5.213935 0.000000 0.000000\n0.000000 6.318894 0.000000\n0.000000 0.000000 5.154385\nMn Ru N\n4 4 8\ndirect\n0.619680 0.881290 0.996645 Mn\n0.380321 0.118710 0.496645 Mn\n0.880321 0.381290 0.496645 Mn\n0.119680 0.618709 0.996645 Mn\n0.565010 0.344930 0.994938 Ru\n0.434991 0.655070 0.494937 Ru\n0.934992 0.844929 0.494937 Ru\n0.065009 0.155070 0.994938 Ru\n0.583348 0.914877 0.350167 N\n0.416653 0.085122 0.850168 N\n0.916654 0.414877 0.850168 N\n0.083347 0.585122 0.350167 N\n0.552147 0.360159 0.380252 N\n0.447854 0.639840 0.880253 N\n0.947854 0.860159 0.880253 N\n0.052147 0.139840 0.380252 N\n",
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"volume": 169.81792786448142,
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"formula_full": "Mn4 Ru4 N8",
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{
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"created_at": "2022-09-04T14:35:57.721901Z",
"updated_at": "2022-09-04T14:35:57.721929Z",
"structure_string": "Li4 Cu4 P4 O16\n1.0\n4.786764 0.000000 0.000000\n0.000000 6.143348 0.000000\n0.000000 0.000000 10.106805\nLi Cu P O\n4 4 4 16\ndirect\n0.554595 0.250000 0.218276 Li\n0.054595 0.750000 0.281724 Li\n0.945404 0.250000 0.718276 Li\n0.445404 0.750000 0.781724 Li\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.500000 0.500000 0.500000 Cu\n0.394551 0.250000 0.901561 P\n0.894550 0.750000 0.598440 P\n0.105449 0.250000 0.401561 P\n0.605449 0.750000 0.098439 P\n0.256112 0.041135 0.842824 O\n0.256112 0.458865 0.842824 O\n0.756112 0.541135 0.657176 O\n0.756112 0.958865 0.657176 O\n0.210376 0.750000 0.605722 O\n0.228510 0.250000 0.549634 O\n0.771489 0.750000 0.450367 O\n0.289624 0.750000 0.105722 O\n0.243887 0.041135 0.342824 O\n0.243887 0.458865 0.342824 O\n0.743887 0.541135 0.157176 O\n0.743887 0.958865 0.157176 O\n0.710375 0.250000 0.894279 O\n0.271489 0.250000 0.049634 O\n0.789624 0.250000 0.394279 O\n0.728510 0.750000 0.950367 O\n",
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"spacegroup": 62
}
]
}