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{
"id": "jvasp-12736",
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"updated_at": "2022-09-04T14:37:07.980014Z",
"structure_string": "As4 S2 O12\n1.0\n4.735681 0.000000 0.000000\n0.000000 4.753086 0.000000\n0.000000 0.000000 11.421365\nAs S O\n4 2 12\ndirect\n0.783948 0.810868 0.307885 As\n0.216052 0.810868 0.692114 As\n0.283948 0.189133 0.192115 As\n0.716052 0.189133 0.807885 As\n0.000000 0.799522 0.000000 S\n0.500000 0.200479 0.500000 S\n0.234890 0.995912 0.040722 O\n0.765110 0.995912 0.959278 O\n0.734890 0.004089 0.459278 O\n0.265110 0.004089 0.540722 O\n0.570035 0.867831 0.743321 O\n0.392678 0.368034 0.403145 O\n0.607322 0.368034 0.596854 O\n0.070035 0.132170 0.756678 O\n0.107322 0.631967 0.903145 O\n0.892678 0.631967 0.096854 O\n0.429965 0.867831 0.256678 O\n0.929965 0.132170 0.243321 O\n",
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{
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"updated_at": "2022-09-04T14:37:07.984390Z",
"structure_string": "Nb4 Co4 Te8\n1.0\n6.365442 -0.000000 -0.000000\n-0.000000 6.873768 -3.734346\n0.000000 0.089651 8.358427\nNb Co Te\n4 4 8\ndirect\n0.500000 0.706897 -0.000000 Nb\n0.000000 0.793104 -0.000000 Nb\n0.500000 0.293104 -0.000000 Nb\n0.000000 0.206897 -0.000000 Nb\n0.643239 0.941976 0.883950 Co\n0.143239 0.558025 0.116050 Co\n0.356761 0.058025 0.116050 Co\n0.856761 0.441975 0.883950 Co\n0.750000 0.089880 0.679761 Te\n0.250000 0.410120 0.320239 Te\n0.250000 0.910120 0.320239 Te\n0.750000 0.589880 0.679761 Te\n0.746618 0.112524 0.225049 Te\n0.246618 0.387475 0.774951 Te\n0.253382 0.887476 0.774951 Te\n0.753382 0.612525 0.225049 Te\n",
"nsites": 16,
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{
"id": "jvasp-56803",
"created_at": "2022-09-04T14:37:07.967475Z",
"updated_at": "2022-09-04T14:37:07.967491Z",
"structure_string": "Ba6 Fe6 Se14\n1.0\n5.514801 -9.551917 -0.000000\n5.514801 9.551917 -0.000000\n0.000000 -0.000000 7.103052\nBa Fe Se\n6 6 14\ndirect\n0.814473 0.628946 0.491850 Ba\n0.185527 0.371054 0.991850 Ba\n0.628946 0.814473 0.991850 Ba\n0.185527 0.814473 0.991850 Ba\n0.371054 0.185527 0.491850 Ba\n0.814473 0.185527 0.491850 Ba\n0.744744 0.255256 0.009702 Fe\n0.744744 0.489487 0.009702 Fe\n0.255256 0.510512 0.509702 Fe\n0.489487 0.744744 0.509702 Fe\n0.510512 0.255256 0.009702 Fe\n0.255256 0.744744 0.509702 Fe\n0.543615 0.456384 0.182742 Se\n0.543616 0.087232 0.182742 Se\n0.863671 0.727343 0.936484 Se\n0.727343 0.863671 0.436484 Se\n0.912768 0.456384 0.182742 Se\n0.272657 0.136328 0.936484 Se\n0.136328 0.272657 0.436484 Se\n0.333333 0.666667 0.240165 Se\n0.666667 0.333333 0.740165 Se\n0.136328 0.863672 0.436484 Se\n0.456384 0.543615 0.682742 Se\n0.456384 0.912768 0.682742 Se\n0.087232 0.543616 0.682742 Se\n0.863672 0.136328 0.936484 Se\n",
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{
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"created_at": "2022-09-04T14:37:07.970698Z",
"updated_at": "2022-09-04T14:37:07.970721Z",
"structure_string": "Ag2 Hg1 I4\n1.0\n6.403211 0.000000 0.000000\n0.000000 6.403211 0.000000\n0.000000 0.000000 6.386119\nAg Hg I\n2 1 4\ndirect\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.000000 0.000000 0.000000 Hg\n0.729512 0.729512 0.233517 I\n0.270488 0.729512 0.766483 I\n0.270488 0.270488 0.233517 I\n0.729512 0.270488 0.766483 I\n",
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{
"id": "jvasp-5317",
"created_at": "2022-09-04T14:37:07.995520Z",
"updated_at": "2022-09-04T14:37:07.995558Z",
"structure_string": "Cu1 C1 O3\n1.0\n3.038860 -0.393096 -0.042230\n-0.084474 4.319007 1.741315\n-0.542975 0.467193 4.602179\nCu C O\n1 1 3\ndirect\n0.463333 0.434879 0.434880 Cu\n0.110538 0.021807 0.021807 C\n0.385619 0.155053 0.155054 O\n0.977757 0.171094 0.707166 O\n0.977757 0.707164 0.171096 O\n",
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{
"id": "jvasp-15162",
"created_at": "2022-09-04T14:37:07.996250Z",
"updated_at": "2022-09-04T14:37:07.996284Z",
"structure_string": "Li2 Ga1 Pd1\n1.0\n3.718495 -0.000000 2.146874\n1.239499 3.505830 2.146874\n-0.000000 -0.000000 4.293747\nLi Ga Pd\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.250000 0.250000 0.250000 Li\n0.749999 0.750000 0.749999 Ga\n0.000000 0.000000 0.000000 Pd\n",
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},
{
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"created_at": "2022-09-04T14:37:08.016795Z",
"updated_at": "2022-09-04T14:37:08.016823Z",
"structure_string": "K4 C1 O4\n1.0\n5.023652 -0.000042 -2.604233\n-1.141947 4.554346 -2.202799\n0.066881 0.100408 6.276449\nK C O\n4 1 4\ndirect\n0.154388 0.470249 0.289378 K\n0.427331 0.180813 0.710613 K\n0.865013 0.529753 0.710624 K\n0.716717 0.819188 0.289385 K\n0.290816 0.000001 0.000000 C\n0.230746 0.928104 0.171920 O\n0.058825 0.071899 0.828082 O\n0.522782 0.243777 0.171884 O\n0.350900 0.756223 0.828114 O\n",
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{
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"structure_string": "Li12 Cu4 S8\n1.0\n-3.927884 3.927884 5.969496\n3.927884 -3.927884 5.969496\n3.927884 3.927884 -5.969496\nLi Cu S\n12 4 8\ndirect\n0.843759 0.156241 0.250000 Li\n0.406240 0.156240 0.812482 Li\n0.593759 0.406240 0.749999 Li\n0.156240 0.406240 0.312483 Li\n-0.000000 -0.000000 0.499999 Li\n0.000000 0.500000 0.000000 Li\n0.156240 0.843759 0.749999 Li\n0.406241 0.593760 0.250000 Li\n0.843759 0.593760 0.687516 Li\n0.499999 0.000000 0.499999 Li\n0.000000 0.000000 0.000000 Li\n0.593760 0.843760 0.187517 Li\n0.246865 0.496865 0.749999 Cu\n0.503134 0.753134 0.749999 Cu\n0.496866 0.246866 0.250000 Cu\n0.753134 0.503135 0.250000 Cu\n0.210702 0.232844 0.977858 S\n0.789298 0.767156 0.022141 S\n0.754985 0.232845 0.522140 S\n0.232844 0.210703 0.477859 S\n0.767155 0.245015 0.977858 S\n0.232845 0.754985 0.022141 S\n0.767156 0.789297 0.522140 S\n0.245015 0.767155 0.477859 S\n",
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"updated_at": "2022-09-04T14:37:08.153402Z",
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"structure_string": "Li2 Ag2 F6\n1.0\n-5.189596 0.239752 1.443693\n2.260790 4.424429 -2.014585\n0.943657 -1.029188 -5.363853\nLi Ag F\n2 2 6\ndirect\n0.324325 0.608425 0.069892 Li\n0.675668 0.391580 0.930102 Li\n0.132099 0.829174 0.467308 Ag\n0.867896 0.170825 0.532689 Ag\n0.039757 0.300850 0.218411 F\n0.563449 0.065161 0.733945 F\n0.283845 0.401652 0.796038 F\n0.716145 0.598337 0.203963 F\n0.436552 -0.065159 0.266048 F\n0.960264 0.699152 0.781607 F\n",
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{
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"created_at": "2022-09-04T14:37:08.342175Z",
"updated_at": "2022-09-04T14:37:08.342208Z",
"structure_string": "Sc4 Ti4 O12\n1.0\n5.115429 0.000000 0.000000\n0.000000 5.505446 0.000000\n0.000000 0.000000 7.517686\nSc Ti O\n4 4 12\ndirect\n0.973456 0.925816 0.758038 Sc\n0.526544 0.425815 0.758038 Sc\n0.473456 0.574185 0.258038 Sc\n0.026544 0.074185 0.258038 Sc\n0.000005 0.499990 0.508046 Ti\n0.499995 -0.000011 0.508046 Ti\n0.500005 0.000011 0.008046 Ti\n-0.000005 0.500011 0.008046 Ti\n0.181047 0.809574 0.078635 O\n0.318971 0.309569 0.437481 O\n0.318953 0.309573 0.078635 O\n0.352253 0.066221 0.758051 O\n0.647747 0.933780 0.258051 O\n0.818953 0.190427 0.578635 O\n0.681047 0.690428 0.578635 O\n0.818971 0.190432 0.937482 O\n0.181029 0.809569 0.437481 O\n0.852254 0.433779 0.258051 O\n0.681029 0.690432 0.937482 O\n0.147747 0.566222 0.758051 O\n",
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}
]
}