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{
"id": "jvasp-119207",
"created_at": "2022-09-04T14:38:52.241732Z",
"updated_at": "2022-09-04T14:38:52.241757Z",
"structure_string": "Ca2 La2 Ti3 Cu1 O12\n1.0\n3.874420 -0.000000 0.000000\n0.000000 3.874420 0.000000\n-0.000000 -0.000000 15.849741\nCa La Ti Cu O\n2 2 3 1 12\ndirect\n0.500000 0.500000 0.621433 Ca\n0.500000 0.500000 0.378567 Ca\n0.500000 0.500000 0.883818 La\n0.500000 0.500000 0.116182 La\n0.000000 0.000000 0.745180 Ti\n0.000000 0.000000 0.254820 Ti\n0.000000 0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Cu\n0.000000 0.000000 0.377851 O\n0.000000 0.000000 0.622149 O\n-0.000000 0.500000 -0.000000 O\n0.500000 0.000000 -0.000000 O\n-0.000000 0.500000 0.254134 O\n0.000000 0.000000 0.134116 O\n-0.000000 0.500000 0.745866 O\n0.500000 0.000000 0.745866 O\n0.500000 0.000000 0.500000 O\n0.000000 0.000000 0.865884 O\n0.500000 0.000000 0.254134 O\n-0.000000 0.500000 0.500000 O\n",
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{
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"structure_string": "Ce2 P10\n1.0\n4.660161 -0.182456 0.000000\n-1.493051 5.369551 0.000000\n0.000000 0.000000 9.613464\nCe P\n2 10\ndirect\n0.415150 0.103942 0.250000 Ce\n0.584850 0.896057 0.750000 Ce\n0.230740 0.559360 0.250000 P\n0.769259 0.440639 0.750000 P\n0.133882 0.479018 0.906636 P\n0.866118 0.520981 0.406636 P\n0.866118 0.520981 0.093364 P\n0.133882 0.479018 0.593363 P\n0.212611 0.109694 0.946713 P\n0.787389 0.890305 0.446713 P\n0.787389 0.890305 0.053286 P\n0.212611 0.109694 0.553286 P\n",
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{
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"updated_at": "2022-09-04T14:37:28.723168Z",
"structure_string": "Li2 Mn4 B4 O12\n1.0\n5.209526 -0.059381 -0.031121\n-2.288042 5.264983 -0.022638\n-0.066570 -2.564509 8.736989\nLi Mn B O\n2 4 4 12\ndirect\n0.254190 0.673088 0.189309 Li\n0.745811 0.326912 0.810691 Li\n0.760068 0.744335 0.398663 Mn\n0.277341 0.752014 0.870275 Mn\n0.722660 0.247985 0.129725 Mn\n0.239933 0.255664 0.601337 Mn\n0.780088 0.744342 0.054033 B\n0.274239 0.741640 0.530111 B\n0.725762 0.258360 0.469889 B\n0.219913 0.255658 0.945967 B\n0.622200 0.282067 0.606945 O\n0.141003 0.332790 0.825325 O\n0.664195 0.359349 0.358464 O\n0.887604 0.704721 0.919106 O\n0.112397 0.295279 0.080894 O\n0.566700 0.838822 0.070626 O\n0.858998 0.667209 0.174675 O\n0.377800 0.717932 0.393055 O\n0.088950 0.863106 0.559064 O\n0.911051 0.136894 0.440936 O\n0.335806 0.640651 0.641536 O\n0.433301 0.161177 0.929374 O\n",
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{
"id": "jvasp-64088",
"created_at": "2022-09-04T14:36:18.935422Z",
"updated_at": "2022-09-04T14:36:18.935432Z",
"structure_string": "Ba4 Mn1 Bi1\n1.0\n-0.000000 4.918430 4.918430\n4.918430 -0.000000 4.918430\n4.918430 4.918430 -0.000000\nBa Mn Bi\n4 1 1\ndirect\n0.125582 0.624806 0.624806 Ba\n0.624806 0.624806 0.624806 Ba\n0.624806 0.125582 0.624806 Ba\n0.624806 0.624806 0.125582 Ba\n0.000000 0.000000 0.000000 Mn\n0.250000 0.250000 0.250000 Bi\n",
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{
"id": "jvasp-88495",
"created_at": "2022-09-04T14:36:09.005626Z",
"updated_at": "2022-09-04T14:36:09.005652Z",
"structure_string": "Sr4 Mn4 O12\n1.0\n5.471405 -0.002734 0.000000\n-2.716442 4.749445 0.000000\n-0.000000 0.000000 9.160096\nSr Mn O\n4 4 12\ndirect\n0.661293 0.338707 0.250000 Sr\n0.020316 0.020316 0.000000 Sr\n0.338706 0.661293 0.750000 Sr\n0.979684 0.979684 0.500000 Sr\n0.682709 0.347117 0.887572 Mn\n0.652883 0.317291 0.612429 Mn\n0.317291 0.652883 0.387572 Mn\n0.347116 0.682709 0.112429 Mn\n0.818967 0.636121 0.732481 O\n0.550922 0.550922 0.000000 O\n0.449077 0.449078 0.500000 O\n0.049511 0.551829 0.980290 O\n0.950488 0.448171 0.480290 O\n0.821006 0.178994 0.750000 O\n0.178993 0.821006 0.250000 O\n0.181032 0.363879 0.232481 O\n0.448170 0.950488 0.519710 O\n0.636120 0.818967 0.267519 O\n0.363879 0.181033 0.767519 O\n0.551829 0.049511 0.019710 O\n",
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{
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"created_at": "2022-09-04T14:37:06.693137Z",
"updated_at": "2022-09-04T14:37:06.693155Z",
"structure_string": "Sr2 Li2 Ni2 F12\n1.0\n2.567985 -4.447881 -0.000000\n2.567985 4.447881 -0.000000\n-0.000000 -0.000000 10.417110\nSr Li Ni F\n2 2 2 12\ndirect\n0.000000 0.000000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.666666 0.333332 0.750000 Li\n0.333332 0.666666 0.250000 Li\n0.333332 0.666666 0.750000 Ni\n0.666666 0.333332 0.250000 Ni\n0.018001 0.638582 0.645890 F\n0.379419 0.361417 0.145890 F\n0.620579 0.981997 0.645890 F\n0.018001 0.379420 0.854110 F\n0.620579 0.638581 0.854110 F\n0.379420 0.018001 0.354110 F\n0.638581 0.620579 0.354110 F\n0.638582 0.018001 0.145890 F\n0.981997 0.361416 0.354110 F\n0.361416 0.981997 0.854110 F\n0.361417 0.379419 0.645890 F\n0.981997 0.620579 0.145890 F\n",
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"formula_full": "Sr2 Li2 Ni2 F12",
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{
"id": "jvasp-63927",
"created_at": "2022-09-04T14:35:58.686934Z",
"updated_at": "2022-09-04T14:35:58.686964Z",
"structure_string": "Ba4 Zn1 Fe1\n1.0\n-0.000000 4.918515 4.918515\n4.918515 -0.000000 4.918515\n4.918515 4.918515 0.000000\nBa Zn Fe\n4 1 1\ndirect\n0.126289 0.624569 0.624569 Ba\n0.624569 0.624569 0.624569 Ba\n0.624569 0.126289 0.624569 Ba\n0.624569 0.624569 0.126289 Ba\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Fe\n",
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{
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"created_at": "2022-09-04T14:38:29.996359Z",
"updated_at": "2022-09-04T14:38:29.996385Z",
"structure_string": "Sr4 Fe2 Cu2 S2 O6\n1.0\n3.884791 0.000000 -0.000000\n0.000000 3.884791 0.000000\n-0.000000 0.000000 15.769109\nSr Fe Cu S O\n4 2 2 2 6\ndirect\n0.500000 0.000000 0.184768 Sr\n0.000000 0.500000 0.815232 Sr\n0.500000 0.000000 0.412203 Sr\n0.000000 0.500000 0.587797 Sr\n0.000000 0.500000 0.307765 Fe\n0.500000 0.000000 0.692235 Fe\n0.500000 0.500000 0.000000 Cu\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.092180 S\n0.500000 0.000000 0.907820 S\n0.500000 0.500000 0.289341 O\n0.000000 0.000000 0.289341 O\n0.000000 0.000000 0.710659 O\n0.500000 0.500000 0.710659 O\n0.000000 0.500000 0.430898 O\n0.500000 0.000000 0.569102 O\n",
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"formula_full": "Sr4 Fe2 Cu2 S2 O6",
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{
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"created_at": "2022-09-04T14:38:29.999143Z",
"updated_at": "2022-09-04T14:38:29.999159Z",
"structure_string": "Rb2 Al2 Sb2 O7\n1.0\n2.867198 -4.966132 0.000000\n2.867198 4.966132 -0.000000\n0.000000 -0.000000 8.356913\nRb Al Sb O\n2 2 2 7\ndirect\n0.333333 0.666667 0.407889 Rb\n0.666667 0.333333 0.592111 Rb\n0.000000 0.000000 0.793075 Al\n0.000000 0.000000 0.206925 Al\n0.666667 0.333333 0.151468 Sb\n0.333333 0.666667 0.848532 Sb\n0.168039 0.336079 0.716736 O\n0.336079 0.168039 0.283264 O\n0.663922 0.831962 0.716736 O\n0.168039 0.831961 0.716736 O\n0.831962 0.663922 0.283264 O\n0.000000 0.000000 0.000000 O\n0.831961 0.168039 0.283264 O\n",
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{
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"structure_string": "Ce2 P10\n1.0\n4.661078 -0.182027 0.000000\n-1.492841 5.369551 0.000000\n0.000000 0.000000 9.613280\nCe P\n2 10\ndirect\n0.415309 0.104063 0.250000 Ce\n0.584691 0.895936 0.750000 Ce\n0.230799 0.559485 0.250000 P\n0.769201 0.440514 0.750000 P\n0.133794 0.478955 0.906628 P\n0.866206 0.521044 0.406628 P\n0.866206 0.521044 0.093372 P\n0.133794 0.478955 0.593372 P\n0.212615 0.109688 0.946758 P\n0.787386 0.890311 0.446758 P\n0.787386 0.890311 0.053242 P\n0.212615 0.109688 0.553242 P\n",
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{
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"created_at": "2022-09-04T14:38:33.072514Z",
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"structure_string": "Tb3 Al9\n1.0\n5.721950 -0.011002 5.492751\n2.334250 5.224184 5.492751\n-0.017002 -0.011002 7.931629\nTb Al\n3 9\ndirect\n0.782266 0.782266 0.782266 Tb\n0.217734 0.217734 0.217734 Tb\n0.000000 0.000000 0.000000 Tb\n0.703053 0.703052 0.263713 Al\n0.703053 0.263713 0.703052 Al\n0.263713 0.703052 0.703052 Al\n0.500000 0.500000 -0.000000 Al\n0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.296948 0.736287 0.296947 Al\n0.296948 0.296948 0.736287 Al\n0.736287 0.296948 0.296947 Al\n",
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},
{
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"created_at": "2022-09-04T14:37:19.707826Z",
"updated_at": "2022-09-04T14:37:19.707836Z",
"structure_string": "Sr4 Mn2 Cu2 S2 O6\n1.0\n3.877164 0.000000 -0.000000\n-0.000000 3.877164 -0.000000\n0.000000 0.000000 15.832524\nSr Mn Cu S O\n4 2 2 2 6\ndirect\n0.500000 0.000000 0.184270 Sr\n0.000000 0.500000 0.815730 Sr\n0.500000 0.000000 0.413700 Sr\n0.000000 0.500000 0.586300 Sr\n0.000000 0.500000 0.305932 Mn\n0.500000 0.000000 0.694068 Mn\n0.500000 0.500000 0.000000 Cu\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.092040 S\n0.500000 0.000000 0.907960 S\n0.500000 0.500000 0.288580 O\n0.000000 0.000000 0.288580 O\n0.000000 0.000000 0.711420 O\n0.500000 0.500000 0.711420 O\n0.000000 0.500000 0.430437 O\n0.500000 0.000000 0.569563 O\n",
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"formula_full": "Sr4 Mn2 Cu2 S2 O6",
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]
}