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{
"id": "jvasp-36914",
"created_at": "2022-09-04T14:37:59.223572Z",
"updated_at": "2022-09-04T14:37:59.223589Z",
"structure_string": "Rb1 Ca1 I3\n1.0\n6.091662 0.000151 0.005232\n-0.001423 6.091045 0.002334\n-0.005044 -0.003444 6.091051\nRb Ca I\n1 1 3\ndirect\n0.001490 0.001653 0.998065 Rb\n0.513583 0.499804 0.497891 Ca\n0.515492 -0.000272 0.498062 I\n0.013941 0.499418 0.498050 I\n0.515499 0.499398 0.997929 I\n",
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{
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"structure_string": "K2 Li8 Cr2 O10\n1.0\n5.544533 -0.010260 0.007481\n-2.755481 5.067325 -0.032409\n-1.185305 -0.900496 8.055575\nK Li Cr O\n2 8 2 10\ndirect\n0.396522 0.251118 0.590719 K\n0.603476 0.748880 0.409281 K\n0.439006 0.640276 0.914509 Li\n0.330371 -0.000378 0.874628 Li\n0.899540 0.614496 0.914628 Li\n0.115637 0.669644 0.623611 Li\n0.884361 0.330354 0.376389 Li\n0.100458 0.385502 0.085372 Li\n0.669627 0.000377 0.125372 Li\n0.560993 0.359722 0.085491 Li\n0.136159 0.909523 0.220976 Cr\n0.863840 0.090475 0.779024 Cr\n0.224441 0.267050 0.913507 O\n0.748870 0.232433 0.940666 O\n0.487708 0.833939 0.726355 O\n0.942342 0.824851 0.729939 O\n0.911056 0.275297 0.617418 O\n0.088943 0.724702 0.382582 O\n0.057656 0.175147 0.270061 O\n0.512290 0.166059 0.273646 O\n0.251128 0.767565 0.059334 O\n0.775557 0.732948 0.086493 O\n",
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{
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"structure_string": "V10 Ge6\n1.0\n3.632850 -6.292280 0.000000\n3.632850 6.292280 -0.000000\n0.000000 -0.000000 4.943142\nV Ge\n10 6\ndirect\n0.758676 0.758676 0.250000 V\n0.758676 0.000000 0.750000 V\n0.000000 0.758676 0.750000 V\n0.000000 0.241324 0.250000 V\n0.241324 0.000000 0.250000 V\n0.241324 0.241324 0.750000 V\n0.333333 0.666667 0.000000 V\n0.666667 0.333333 0.500000 V\n0.666667 0.333333 0.000000 V\n0.333333 0.666667 0.500000 V\n0.391810 0.391810 0.250000 Ge\n0.391810 0.000000 0.750000 Ge\n0.000000 0.391810 0.750000 Ge\n0.000000 0.608190 0.250000 Ge\n0.608190 0.000000 0.250000 Ge\n0.608190 0.608190 0.750000 Ge\n",
"nsites": 16,
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"elements": [
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"formula_full": "V10 Ge6",
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{
"id": "jvasp-66258",
"created_at": "2022-09-04T14:35:59.419453Z",
"updated_at": "2022-09-04T14:35:59.419484Z",
"structure_string": "Ba4 Zn1 Mo1\n1.0\n0.000000 4.834484 4.834484\n4.834484 -0.000000 4.834484\n4.834484 4.834484 -0.000000\nBa Zn Mo\n4 1 1\ndirect\n0.126670 0.624443 0.624443 Ba\n0.624443 0.624443 0.624443 Ba\n0.624443 0.126670 0.624443 Ba\n0.624443 0.624443 0.126670 Ba\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Mo\n",
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{
"id": "jvasp-36453",
"created_at": "2022-09-04T14:37:18.631490Z",
"updated_at": "2022-09-04T14:37:18.631516Z",
"structure_string": "Sr3 Sb1 N1\n1.0\n6.091065 0.000000 -0.000000\n0.000000 6.091065 0.000000\n-0.000000 0.000000 6.091065\nSr Sb N\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 N\n",
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{
"id": "jvasp-39441",
"created_at": "2022-09-04T14:37:53.140343Z",
"updated_at": "2022-09-04T14:37:53.140364Z",
"structure_string": "Ho6 Mg2\n1.0\n3.455235 -5.984643 0.000000\n3.455235 5.984643 0.000000\n-0.000000 -0.000000 5.464023\nHo Mg\n6 2\ndirect\n0.661089 0.830544 0.750000 Ho\n0.169455 0.338910 0.750000 Ho\n0.169455 0.830544 0.750000 Ho\n0.830544 0.169455 0.250000 Ho\n0.830544 0.661089 0.250000 Ho\n0.338910 0.169455 0.250000 Ho\n0.666666 0.333332 0.750000 Mg\n0.333332 0.666666 0.250000 Mg\n",
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{
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"created_at": "2022-09-04T14:35:48.046023Z",
"updated_at": "2022-09-04T14:35:48.046065Z",
"structure_string": "Ba4 Tc1 Te1\n1.0\n0.000000 4.834332 4.834332\n4.834332 0.000000 4.834332\n4.834332 4.834332 0.000000\nBa Tc Te\n4 1 1\ndirect\n0.125945 0.624685 0.624685 Ba\n0.624685 0.624685 0.624685 Ba\n0.624685 0.125945 0.624685 Ba\n0.624685 0.624685 0.125945 Ba\n0.250000 0.250000 0.250000 Tc\n0.000000 0.000000 0.000000 Te\n",
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{
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"created_at": "2022-09-04T14:37:15.411498Z",
"updated_at": "2022-09-04T14:37:15.411520Z",
"structure_string": "Mg4 Sn4 O12\n1.0\n5.316526 -0.000000 0.000000\n-0.000000 5.437304 0.000000\n0.000000 0.000000 7.816687\nMg Sn O\n4 4 12\ndirect\n0.001973 0.041828 0.250000 Mg\n0.501973 0.458171 0.750000 Mg\n0.498027 0.541828 0.250000 Mg\n-0.001973 0.958171 0.750000 Mg\n0.500000 0.000000 0.000000 Sn\n0.000000 0.500000 0.000000 Sn\n0.000000 0.500000 0.500000 Sn\n0.500000 0.000000 0.500000 Sn\n0.169827 0.175267 0.928071 O\n0.669827 0.324733 0.071930 O\n0.330173 0.675267 0.928071 O\n0.830174 0.824732 0.071930 O\n0.169827 0.175267 0.571930 O\n0.364726 0.911460 0.250000 O\n0.135275 0.411461 0.250000 O\n0.635275 0.088539 0.750000 O\n0.330173 0.675267 0.571930 O\n0.864726 0.588539 0.750000 O\n0.669827 0.324733 0.428070 O\n0.830174 0.824732 0.428070 O\n",
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{
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"created_at": "2022-09-04T14:38:02.491789Z",
"updated_at": "2022-09-04T14:38:02.491820Z",
"structure_string": "Mg4 Sn4 O12\n1.0\n5.316359 -0.000000 0.000000\n0.000000 5.437297 0.000000\n0.000000 0.000000 7.816916\nMg Sn O\n4 4 12\ndirect\n0.998066 0.958152 0.750000 Mg\n0.501935 0.458152 0.750000 Mg\n0.498066 0.541848 0.250000 Mg\n0.001935 0.041848 0.250000 Mg\n0.000000 0.500000 0.000000 Sn\n0.000000 0.500000 0.500000 Sn\n0.500000 0.000000 0.500000 Sn\n0.500000 0.000000 0.000000 Sn\n0.830162 0.824719 0.071954 O\n0.669838 0.324719 0.428046 O\n0.669838 0.324719 0.071954 O\n0.635294 0.088538 0.750000 O\n0.364706 0.911462 0.250000 O\n0.169838 0.175281 0.571955 O\n0.330162 0.675282 0.571955 O\n0.169838 0.175281 0.928046 O\n0.830162 0.824719 0.428046 O\n0.135294 0.411462 0.250000 O\n0.330162 0.675282 0.928046 O\n0.864707 0.588538 0.750000 O\n",
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{
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"created_at": "2022-09-04T14:38:14.626463Z",
"updated_at": "2022-09-04T14:38:14.626481Z",
"structure_string": "Na2 Ca2 Ta3 O10\n1.0\n3.941722 0.000000 -0.529862\n-0.071227 3.941078 -0.529862\n-0.049402 -0.050302 14.558953\nNa Ca Ta O\n2 2 3 10\ndirect\n0.711667 0.711668 0.423335 Na\n0.288333 0.288333 0.576665 Na\n0.576527 0.576528 0.153055 Ca\n0.423472 0.423473 0.846945 Ca\n0.855847 0.855849 0.711698 Ta\n0.000000 0.000000 0.000000 Ta\n0.144152 0.144152 0.288302 Ta\n0.069076 0.069076 0.138152 O\n0.790621 0.790623 0.581244 O\n0.930923 0.930925 0.861848 O\n0.633716 0.133716 0.267432 O\n0.133716 0.633716 0.267432 O\n0.366283 0.866285 0.732568 O\n0.866284 0.366285 0.732568 O\n0.209378 0.209378 0.418756 O\n0.500000 0.000000 0.000000 O\n-0.000000 0.500000 0.000000 O\n",
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{
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"created_at": "2022-09-04T14:38:42.393732Z",
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"structure_string": "Sn1 H12 C7 O4\n1.0\n5.036731 0.064214 -0.153047\n-0.789998 6.229083 -0.617983\n-0.038330 0.130894 7.177848\nSn H C O\n1 12 7 4\ndirect\n0.869387 0.647669 0.643925 Sn\n0.850644 0.240430 0.490554 H\n0.029063 0.421676 0.343729 H\n0.089755 0.905528 0.934183 H\n0.957270 0.068515 0.767465 H\n0.265724 -0.042430 0.724859 H\n0.186565 0.351526 0.557101 H\n0.530118 0.422639 0.205808 H\n0.831954 0.135878 0.145523 H\n0.599987 0.000808 0.975983 H\n0.288645 0.889047 0.205432 H\n0.399228 0.103851 0.364488 H\n0.297288 0.298354 0.029956 H\n0.471597 0.989335 0.259063 C\n0.618129 0.105275 0.106896 C\n0.509654 0.318117 0.073956 C\n0.666005 0.437036 0.931566 C\n-0.001185 0.379808 0.486989 C\n0.070183 0.932938 0.786164 C\n0.639828 0.852740 0.366596 C\n0.526197 0.756410 0.503150 O\n0.535901 0.529258 0.806111 O\n0.917256 0.448026 0.928462 O\n0.881116 0.836397 0.337403 O\n",
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{
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"created_at": "2022-09-04T14:38:14.244928Z",
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"structure_string": "K2 Ru1 Cl6\n1.0\n5.920610 -0.000000 3.418266\n1.973537 5.582005 3.418266\n-0.000000 -0.000000 6.836531\nK Ru Cl\n2 1 6\ndirect\n0.750001 0.749999 0.750001 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Ru\n0.242340 0.757660 0.757661 Cl\n0.242340 0.757660 0.242340 Cl\n0.757661 0.242339 0.757661 Cl\n0.757661 0.242339 0.242340 Cl\n0.757661 0.757660 0.242340 Cl\n0.242340 0.242339 0.757661 Cl\n",
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}
]
}