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{
"id": "jvasp-86231",
"created_at": "2022-09-04T14:35:47.077417Z",
"updated_at": "2022-09-04T14:35:47.077454Z",
"structure_string": "Li2 Sn12 Pd4\n1.0\n6.769556 0.000000 0.000000\n0.000000 6.769556 0.000000\n-0.000000 0.000000 8.765602\nLi Sn Pd\n2 12 4\ndirect\n0.000000 0.000000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.841559 0.658441 0.679048 Sn\n0.841559 0.658441 0.320951 Sn\n0.658441 0.158441 0.679048 Sn\n0.336278 0.163722 0.000000 Sn\n0.163722 0.663723 0.000000 Sn\n0.663723 0.836278 0.000000 Sn\n0.158441 0.341559 0.320951 Sn\n0.158441 0.341559 0.679048 Sn\n0.341559 0.841559 0.320951 Sn\n0.658441 0.158441 0.320951 Sn\n0.836278 0.336278 0.000000 Sn\n0.341559 0.841559 0.679048 Sn\n0.000000 0.000000 0.182688 Pd\n0.500000 0.500000 0.182688 Pd\n0.500000 0.500000 0.817312 Pd\n0.000000 0.000000 0.817312 Pd\n",
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{
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"structure_string": "Fe1 Bi1 O3\n1.0\n3.931155 0.022461 0.063866\n0.063200 3.930712 0.063866\n0.022695 0.022461 3.931609\nFe Bi O\n1 1 3\ndirect\n0.503638 0.503634 0.503637 Fe\n0.072370 0.072368 0.072369 Bi\n0.995825 0.478586 0.478587 O\n0.478588 0.478586 0.995823 O\n0.478587 0.995823 0.478587 O\n",
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{
"id": "jvasp-86229",
"created_at": "2022-09-04T14:36:17.648647Z",
"updated_at": "2022-09-04T14:36:17.648671Z",
"structure_string": "Tl2 P2 Au2 Se6\n1.0\n6.458711 0.021447 -3.005196\n-3.883328 5.970670 -0.132130\n0.014311 -0.006659 8.347047\nTl P Au Se\n2 2 2 6\ndirect\n0.943249 0.285504 0.228752 Tl\n0.056750 0.714497 0.771248 Tl\n0.621613 0.030925 0.652539 P\n0.378386 0.969075 0.347461 P\n0.760394 0.760394 -0.000000 Au\n0.239606 0.239606 -0.000000 Au\n0.422924 0.764141 0.187065 Se\n0.518538 0.322455 0.327267 Se\n0.577075 0.235860 0.812935 Se\n0.481461 0.677545 0.672733 Se\n0.004812 0.808730 0.327267 Se\n0.995188 0.191271 0.672733 Se\n",
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{
"id": "jvasp-86228",
"created_at": "2022-09-04T14:36:14.089417Z",
"updated_at": "2022-09-04T14:36:14.089428Z",
"structure_string": "Si3 Pd6\n1.0\n7.809887 0.000000 0.000000\n-3.904943 6.763561 0.000000\n-0.000000 0.000000 2.765675\nSi Pd\n3 6\ndirect\n0.000000 0.000000 0.500001 Si\n0.666667 0.333333 0.000000 Si\n0.333333 0.666667 0.000000 Si\n0.000000 0.253878 0.000000 Pd\n0.602124 -0.000000 0.000000 Pd\n0.746123 0.746122 0.000000 Pd\n0.000000 0.602124 0.000000 Pd\n0.397876 0.397876 0.000000 Pd\n0.253878 -0.000000 0.000000 Pd\n",
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"elements": [
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{
"id": "jvasp-86226",
"created_at": "2022-09-04T14:36:09.273412Z",
"updated_at": "2022-09-04T14:36:09.273437Z",
"structure_string": "Ca3 B6 Rh8\n1.0\n5.260690 -0.000000 1.697295\n2.630345 4.883838 0.848647\n0.002078 -0.000000 8.994841\nCa B Rh\n3 6 8\ndirect\n0.681579 0.000000 0.636842 Ca\n0.318422 0.000000 0.363157 Ca\n0.500000 0.000000 -0.000000 Ca\n0.832919 0.334162 -0.000000 B\n0.986964 0.682479 0.343590 B\n0.167080 0.665838 0.000000 B\n0.013035 0.317522 0.656409 B\n0.330556 0.682479 0.656409 B\n0.669443 0.317522 0.343590 B\n0.913221 0.000000 0.173559 Rh\n0.415108 0.500000 0.169783 Rh\n0.086780 0.000000 0.826441 Rh\n0.584892 0.500000 0.830216 Rh\n0.915108 0.500000 0.169783 Rh\n0.084892 0.500000 0.830217 Rh\n0.750000 0.500000 0.500000 Rh\n0.250000 0.500000 0.500000 Rh\n",
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"formula_full": "Ca3 B6 Rh8",
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{
"id": "jvasp-86225",
"created_at": "2022-09-04T14:36:04.860841Z",
"updated_at": "2022-09-04T14:36:04.860874Z",
"structure_string": "Tl2 Hg1 Ge1 Te4\n1.0\n6.754310 0.006613 -1.848122\n-3.932149 5.491717 -1.848122\n-0.003395 -0.006613 7.002589\nTl Hg Ge Te\n2 1 1 4\ndirect\n0.000001 0.500001 0.500001 Tl\n0.500000 0.000000 0.500000 Tl\n0.500000 0.500000 0.000000 Hg\n0.000000 0.000000 0.000000 Ge\n0.953044 0.599299 0.000000 Te\n0.400701 0.400701 0.353747 Te\n0.046956 0.046956 0.646254 Te\n0.599299 0.953045 0.000001 Te\n",
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{
"id": "jvasp-86222",
"created_at": "2022-09-04T14:36:02.102396Z",
"updated_at": "2022-09-04T14:36:02.102413Z",
"structure_string": "Sb4 I12\n1.0\n7.342832 0.093759 0.000000\n-2.963133 8.099893 0.000000\n0.000000 0.000000 10.981405\nSb I\n4 12\ndirect\n0.040535 0.667055 0.673854 Sb\n0.040535 0.167055 0.826145 Sb\n0.959465 0.832945 0.173854 Sb\n0.959465 0.332945 0.326145 Sb\n0.225966 0.699260 0.442152 I\n0.340141 0.458592 0.742050 I\n0.340141 0.958591 0.757949 I\n0.777779 0.325291 0.907094 I\n0.222221 0.674709 0.092905 I\n0.777779 0.825291 0.592905 I\n0.774034 0.300740 0.557847 I\n0.225966 0.199260 0.057848 I\n0.774034 0.800740 0.942152 I\n0.222221 0.174709 0.407094 I\n0.659859 0.041408 0.242051 I\n0.659859 0.541408 0.257949 I\n",
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{
"id": "jvasp-86221",
"created_at": "2022-09-04T14:35:59.098753Z",
"updated_at": "2022-09-04T14:35:59.098785Z",
"structure_string": "Er4 Ru8\n1.0\n5.232791 0.000000 0.000000\n-2.616396 4.531730 0.000000\n0.000000 0.000000 8.859971\nEr Ru\n4 8\ndirect\n0.333332 0.666667 0.432931 Er\n0.666667 0.333333 0.567069 Er\n0.666667 0.333333 0.932930 Er\n0.333332 0.666667 0.067069 Er\n0.171030 0.342062 0.750000 Ru\n0.171030 0.828970 0.750000 Ru\n0.342061 0.171030 0.250000 Ru\n0.828969 0.657938 0.250000 Ru\n0.657938 0.828970 0.750000 Ru\n0.000000 0.000000 0.000000 Ru\n0.828969 0.171030 0.250000 Ru\n0.000000 0.000000 0.500000 Ru\n",
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{
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"created_at": "2022-09-04T14:35:54.584646Z",
"updated_at": "2022-09-04T14:35:54.584657Z",
"structure_string": "Ba6 Al6 Ga4\n1.0\n5.970236 -0.000000 0.000000\n-2.985118 5.170376 -0.000000\n-0.000000 -0.000000 14.728682\nBa Al Ga\n6 6 4\ndirect\n0.333333 0.666668 0.877778 Ba\n0.666667 0.333333 0.377778 Ba\n0.666667 0.333333 0.122222 Ba\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666668 0.622222 Ba\n0.000000 0.000000 0.500000 Ba\n0.841613 0.683227 0.750000 Al\n0.683227 0.841613 0.250000 Al\n0.841613 0.158387 0.750000 Al\n0.158387 0.841613 0.250000 Al\n0.316774 0.158387 0.750000 Al\n0.158387 0.316774 0.250000 Al\n0.666667 0.333333 0.888216 Ga\n0.333333 0.666668 0.111784 Ga\n0.333333 0.666668 0.388216 Ga\n0.666667 0.333333 0.611783 Ga\n",
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{
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"created_at": "2022-09-04T14:37:04.440838Z",
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"structure_string": "In1 Fe2 O4\n1.0\n3.279663 -0.029938 8.136637\n1.553798 2.888391 8.136637\n-0.050624 -0.029938 8.772598\nIn Fe O\n1 2 4\ndirect\n0.000000 0.000000 0.000000 In\n0.786021 0.786019 0.786022 Fe\n0.213981 0.213979 0.213981 Fe\n0.708023 0.708021 0.708022 O\n0.291979 0.291976 0.291979 O\n0.872723 0.872722 0.872722 O\n0.127276 0.127279 0.127278 O\n",
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{
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"created_at": "2022-09-04T14:35:51.511008Z",
"updated_at": "2022-09-04T14:35:51.511023Z",
"structure_string": "K4 Os2 N2 Cl10\n1.0\n8.204728 0.000000 0.000000\n0.000000 7.441099 -2.194697\n0.000000 0.581057 7.736215\nK Os N Cl\n4 2 2 10\ndirect\n0.874545 0.562503 0.437497 K\n0.561549 0.095502 0.904498 K\n0.374545 0.437497 0.562503 K\n0.061549 0.904499 0.095501 K\n0.521467 0.765085 0.234915 Os\n0.021467 0.234916 0.765084 Os\n0.214635 0.192232 0.807768 N\n0.714635 0.807769 0.192231 N\n0.915044 0.945463 0.721484 Cl\n0.548878 0.455142 0.204899 Cl\n0.213963 0.679597 0.320403 Cl\n0.415044 0.721485 0.945462 Cl\n0.713964 0.320404 0.679596 Cl\n0.548878 0.795101 0.544858 Cl\n0.415044 0.054537 0.278515 Cl\n0.048878 0.204900 0.455141 Cl\n0.048878 0.544859 0.795100 Cl\n0.915044 0.278515 0.054537 Cl\n",
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}