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{
"id": "jvasp-101260",
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{
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{
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"structure_string": "Zn4 H8 O8\n1.0\n0.000000 4.825981 -0.017585\n8.580348 0.000000 0.000000\n0.000000 -0.018190 -5.104011\nZn H O\n4 8 8\ndirect\n0.676532 0.632901 0.642287 Zn\n0.823493 0.380215 0.142204 Zn\n0.176507 0.880215 0.857795 Zn\n0.323468 0.132901 0.357712 Zn\n0.289072 0.416674 0.360030 H\n0.210968 0.596450 0.860155 H\n0.710928 0.916674 0.639969 H\n0.789031 0.096450 0.139844 H\n0.994585 0.909337 0.328935 H\n0.005415 0.409337 0.671064 H\n0.494687 0.603820 0.171181 H\n0.505313 0.103820 0.828818 H\n0.362879 0.675381 0.885270 O\n0.568666 0.533098 0.311597 O\n0.931442 0.480032 0.811538 O\n0.068558 0.980032 0.188461 O\n0.431334 0.033098 0.688402 O\n0.862855 0.837753 0.614863 O\n0.637121 0.175381 0.114729 O\n0.137145 0.337753 0.385136 O\n",
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{
"id": "jvasp-69919",
"created_at": "2022-09-04T14:36:07.228422Z",
"updated_at": "2022-09-04T14:36:07.228450Z",
"structure_string": "Li1 Be2 Re1\n1.0\n-1.675771 1.675771 3.763062\n1.675771 -1.675771 3.763062\n1.675771 1.675771 -3.763062\nLi Be Re\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.750000 0.250000 0.500000 Re\n",
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{
"id": "jvasp-54739",
"created_at": "2022-09-04T14:38:12.287249Z",
"updated_at": "2022-09-04T14:38:12.287279Z",
"structure_string": "Zn4 H8 O8\n1.0\n4.825616 0.000000 0.000000\n0.000000 5.103708 0.000000\n0.000000 0.000000 8.581419\nZn H O\n4 8 8\ndirect\n0.573426 0.642397 0.123674 Zn\n0.426575 0.142397 0.376326 Zn\n0.073426 0.857604 0.876326 Zn\n0.926575 0.357603 0.623674 Zn\n0.961003 0.360290 0.339931 H\n0.038997 0.860290 0.160069 H\n0.538998 0.639710 0.839931 H\n0.461003 0.139710 0.660069 H\n0.255387 0.328711 0.847245 H\n0.244614 0.671289 0.347245 H\n0.755387 0.171289 0.152755 H\n0.744614 0.828712 0.652755 H\n0.887081 0.885364 0.081139 O\n0.681484 0.311741 0.223484 O\n0.318517 0.811741 0.276516 O\n0.181483 0.188260 0.776516 O\n0.818518 0.688260 0.723484 O\n0.387081 0.614636 0.918861 O\n0.612920 0.114636 0.581139 O\n0.112920 0.385364 0.418861 O\n",
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{
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"created_at": "2022-09-04T14:35:57.645710Z",
"updated_at": "2022-09-04T14:35:57.645733Z",
"structure_string": "Na2 V12 O22\n1.0\n5.674403 0.000000 -0.000000\n-2.837201 4.914177 0.000000\n0.000000 -0.000000 13.642592\nNa V O\n2 12 22\ndirect\n0.666667 0.333333 0.750000 Na\n0.333333 0.666667 0.250000 Na\n0.500000 0.000000 0.500000 V\n0.333333 0.666667 0.750000 V\n0.666667 0.333333 0.250000 V\n0.000000 0.500000 0.000000 V\n0.000000 0.000000 0.850709 V\n0.000000 0.500000 0.500000 V\n0.500000 0.500000 0.500000 V\n0.500000 0.500000 0.000000 V\n0.000000 0.000000 0.649290 V\n0.000000 0.000000 0.149290 V\n0.500000 0.000000 0.000000 V\n0.000000 0.000000 0.350709 V\n0.333333 0.666667 0.599282 O\n0.333333 0.666667 0.900718 O\n0.330737 0.165368 0.574529 O\n0.834632 0.669263 0.925470 O\n0.669263 0.834632 0.074529 O\n0.666667 0.333333 0.099282 O\n0.834631 0.165368 0.574529 O\n0.165369 0.834632 0.425470 O\n0.165368 0.330738 0.425470 O\n0.866844 0.133156 0.750000 O\n0.266311 0.133156 0.750000 O\n0.834632 0.669263 0.574529 O\n0.165368 0.330738 0.074529 O\n0.330737 0.165368 0.925470 O\n0.133156 0.266311 0.250000 O\n0.133156 0.866845 0.250000 O\n0.666667 0.333333 0.400718 O\n0.733689 0.866845 0.250000 O\n0.165369 0.834632 0.074529 O\n0.669263 0.834632 0.425470 O\n0.834631 0.165368 0.925470 O\n0.866844 0.733689 0.750000 O\n",
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"formula_full": "Na2 V12 O22",
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},
{
"id": "jvasp-44512",
"created_at": "2022-09-04T14:36:03.047714Z",
"updated_at": "2022-09-04T14:36:03.047739Z",
"structure_string": "Li4 Mn5 Nb1 O12\n1.0\n5.049160 0.210842 -0.447182\n-2.353135 4.472274 -0.447182\n-0.860487 -1.494704 10.359292\nLi Mn Nb O\n4 5 1 12\ndirect\n0.292270 0.638332 0.730561 Li\n0.361669 0.707730 0.269440 Li\n0.638332 0.292270 0.730560 Li\n0.707730 0.361668 0.269440 Li\n0.164819 0.835181 0.500000 Mn\n0.335490 0.664510 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.664511 0.335489 0.000000 Mn\n0.835181 0.164819 0.500000 Mn\n0.000000 0.000000 0.000000 Nb\n0.857214 0.515285 0.610339 O\n0.484715 0.142786 0.389661 O\n0.764744 0.764744 0.401654 O\n0.596997 0.596997 0.894063 O\n0.403003 0.403003 0.105937 O\n0.109767 0.758108 0.112322 O\n0.515286 0.857214 0.610339 O\n0.142786 0.484715 0.389661 O\n0.241892 0.890234 0.887678 O\n0.758109 0.109766 0.112322 O\n0.235256 0.235256 0.598346 O\n0.890234 0.241892 0.887678 O\n",
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{
"id": "jvasp-12651",
"created_at": "2022-09-04T14:37:27.516854Z",
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"structure_string": "Mn4 Ge2 O8\n1.0\n2.983285 0.000000 0.000000\n0.000000 5.286355 0.000000\n0.000000 -0.000000 9.380166\nMn Ge O\n4 2 8\ndirect\n0.499999 0.440841 0.824550 Mn\n0.499999 0.559160 0.175450 Mn\n0.499999 0.940842 0.675451 Mn\n0.499999 0.059159 0.324550 Mn\n0.000000 0.500000 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n0.000000 0.132572 0.811582 O\n0.000000 0.867429 0.188418 O\n0.000000 0.632572 0.688419 O\n0.000000 0.367429 0.311582 O\n0.499999 0.267047 0.543214 O\n0.499999 0.732954 0.456786 O\n0.499999 0.232954 0.043214 O\n0.499999 0.767047 0.956786 O\n",
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{
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},
{
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"structure_string": "Be2 Ni1 Pt1\n1.0\n2.803120 0.000000 0.000000\n0.000000 2.803120 0.000000\n-0.000000 0.000000 5.378563\nBe Ni Pt\n2 1 1\ndirect\n0.000000 0.000000 0.022484 Be\n0.500000 0.500000 0.249060 Be\n0.000000 0.000000 0.439712 Ni\n0.500000 0.500000 0.788743 Pt\n",
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},
{
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"created_at": "2022-09-04T14:38:33.700600Z",
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"structure_string": "Li4 Mn2 Si2 O8\n1.0\n4.995106 0.000000 0.000000\n0.000000 5.355460 0.000000\n0.000000 0.000000 6.318914\nLi Mn Si O\n4 2 2 8\ndirect\n0.556401 0.330370 0.250577 Li\n0.556401 0.330370 0.749423 Li\n0.056401 0.669630 0.750576 Li\n0.056401 0.669630 0.249423 Li\n0.558512 0.826837 0.000000 Mn\n0.058511 0.173163 0.500000 Mn\n0.049960 0.177682 0.000000 Si\n0.549961 0.822318 0.500000 Si\n0.718682 0.182889 0.000000 O\n0.163367 0.321855 0.213720 O\n0.663367 0.678145 0.713720 O\n0.218682 0.817111 0.500000 O\n0.148353 0.881206 0.000000 O\n0.648353 0.118794 0.500000 O\n0.663367 0.678145 0.286279 O\n0.163367 0.321855 0.786279 O\n",
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"formula_full": "Li4 Mn2 Si2 O8",
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}
]
}