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{
"id": "jvasp-119310",
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"structure_string": "Li2 Fe2 Mo4 O16\n1.0\n6.227524 -0.087205 -2.227214\n-2.067194 6.864443 -0.094783\n-0.035693 0.015516 6.943695\nLi Fe Mo O\n2 2 4 16\ndirect\n0.775171 0.447011 0.274694 Li\n0.224830 0.552990 0.725307 Li\n0.407934 0.096261 0.326018 Fe\n0.592066 0.903740 0.673983 Fe\n0.820559 0.964005 0.227521 Mo\n0.334814 0.573778 0.285409 Mo\n0.179442 0.035996 0.772479 Mo\n0.665187 0.426223 0.714592 Mo\n0.294172 0.282287 0.740503 O\n0.123314 0.049464 0.362606 O\n0.097413 0.482604 0.348588 O\n0.759777 0.962360 0.958955 O\n0.470928 0.374007 0.342190 O\n0.239759 0.571953 0.023075 O\n0.902588 0.517397 0.651413 O\n0.876687 0.950536 0.637395 O\n0.684143 0.136151 0.279354 O\n0.419827 0.845855 0.387381 O\n0.760242 0.428048 0.976925 O\n0.705828 0.717714 0.259498 O\n0.240223 0.037641 0.041046 O\n0.580174 0.154146 0.612619 O\n0.529073 0.625993 0.657810 O\n0.315858 0.863850 0.720647 O\n",
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{
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"structure_string": "Ca6 Sc2 Co2 O12\n1.0\n6.348228 0.007231 -0.266467\n-0.278189 6.342134 -0.266467\n0.006913 0.007231 6.353814\nCa Sc Co O\n6 2 2 12\ndirect\n0.380221 0.749999 0.119778 Ca\n0.750000 0.119778 0.380221 Ca\n0.119778 0.380221 0.749999 Ca\n0.880221 0.619778 0.249999 Ca\n0.250000 0.880221 0.619778 Ca\n0.619778 0.250000 0.880220 Ca\n0.250000 0.250000 0.250000 Sc\n0.750000 0.749999 0.749999 Sc\n0.500000 0.500000 0.499999 Co\n0.000000 0.000000 0.000000 Co\n0.791525 0.456830 0.587850 O\n0.543169 0.412148 0.208475 O\n0.412149 0.208475 0.543169 O\n0.456830 0.587851 0.791524 O\n0.043169 0.708475 0.912148 O\n0.087851 0.956830 0.291524 O\n0.956831 0.291524 0.087851 O\n0.708475 0.912148 0.043169 O\n0.912149 0.043169 0.708474 O\n0.291524 0.087851 0.956830 O\n0.208475 0.543169 0.412148 O\n0.587851 0.791524 0.456830 O\n",
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{
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"updated_at": "2022-09-04T14:38:40.762500Z",
"structure_string": "Rb4 Al2 O2 F10\n1.0\n6.280203 0.059439 -0.000000\n-0.976872 6.204047 0.000000\n-0.000000 -0.000000 7.549850\nRb Al O F\n4 2 2 10\ndirect\n0.501892 0.957873 0.250000 Rb\n0.042127 0.498108 0.750000 Rb\n0.498108 0.042127 0.750000 Rb\n0.957872 0.501892 0.250000 Rb\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.422040 0.422041 0.250000 O\n0.577960 0.577960 0.750000 O\n0.778054 0.778054 0.990613 F\n0.221946 0.221946 0.009387 F\n0.778054 0.778054 0.509387 F\n0.221946 0.221946 0.490613 F\n0.189470 0.810530 0.500000 F\n0.810530 0.189470 0.500000 F\n0.189470 0.810530 0.000000 F\n0.988689 0.988690 0.250000 F\n0.810530 0.189470 0.000000 F\n0.011311 0.011311 0.750000 F\n",
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{
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"structure_string": "Pr1 Zn1 Ag1 As2\n1.0\n4.338941 -0.000000 0.000000\n-2.169471 3.757634 -0.000000\n-0.000000 0.000000 6.972483\nPr Zn Ag As\n1 1 1 2\ndirect\n0.000000 0.000000 0.986031 Pr\n0.666667 0.333333 0.373881 Zn\n0.333333 0.666666 0.640471 Ag\n0.333333 0.666666 0.248337 As\n0.666667 0.333333 0.751281 As\n",
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{
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"created_at": "2022-09-04T14:38:39.737340Z",
"updated_at": "2022-09-04T14:38:39.737363Z",
"structure_string": "Sr4 V2 Mo2 O12\n1.0\n6.412640 -0.000007 2.242669\n-3.206259 5.540200 2.275422\n0.000127 -0.000007 6.793492\nSr V Mo O\n4 2 2 12\ndirect\n0.500001 0.500000 0.500000 Sr\n0.000000 0.499999 0.000001 Sr\n0.500000 0.000000 0.000000 Sr\n0.000000 0.000001 0.499998 Sr\n0.000000 -0.000001 0.999999 V\n0.500000 0.999999 0.500000 V\n0.000000 0.500000 0.500000 Mo\n0.500000 0.500000 -0.000000 Mo\n1.000000 0.247102 0.752898 O\n0.499999 0.247103 0.252896 O\n0.252898 0.752895 0.500002 O\n0.752895 0.752894 0.000001 O\n0.747103 0.247103 0.499999 O\n0.749999 -0.000000 0.249999 O\n0.250002 0.500000 0.249998 O\n0.749998 0.499999 0.750002 O\n0.500001 0.752895 0.747103 O\n0.250001 -0.000001 0.750000 O\n0.247105 0.247104 0.999999 O\n0.999999 0.752897 0.247104 O\n",
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{
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"created_at": "2022-09-04T14:38:32.938896Z",
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"structure_string": "Sr6 Sn2 N1 F1\n1.0\n-0.000000 5.207956 5.207956\n5.207956 0.000000 5.207956\n5.207956 5.207956 -0.000000\nSr Sn N F\n6 2 1 1\ndirect\n0.242398 0.757602 0.757602 Sr\n0.242398 0.757602 0.242398 Sr\n0.757602 0.242398 0.757602 Sr\n0.757602 0.757602 0.242398 Sr\n0.242398 0.242398 0.757602 Sr\n0.757602 0.242398 0.242398 Sr\n0.250000 0.250000 0.250000 Sn\n0.750001 0.750001 0.750001 Sn\n0.000000 0.000000 0.000000 N\n0.500000 0.500000 0.500000 F\n",
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{
"id": "jvasp-110342",
"created_at": "2022-09-04T14:38:38.823779Z",
"updated_at": "2022-09-04T14:38:38.823805Z",
"structure_string": "K2 Na1 Sm1 Cl6\n1.0\n6.527051 0.000000 3.768395\n2.175683 6.153763 3.768395\n-0.000000 0.000000 7.536790\nK Na Sm Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sm\n0.749778 0.250221 0.250221 Cl\n0.250221 0.250221 0.749778 Cl\n0.250221 0.749778 0.749778 Cl\n0.250221 0.749778 0.250221 Cl\n0.749778 0.250221 0.749778 Cl\n0.749778 0.749778 0.250221 Cl\n",
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{
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"created_at": "2022-09-04T14:38:40.790075Z",
"updated_at": "2022-09-04T14:38:40.790107Z",
"structure_string": "Zn1 Cr4 Cd1 Se8\n1.0\n6.552737 0.000000 3.783224\n2.184245 6.177979 3.783224\n0.000000 0.000000 7.566449\nZn Cr Cd Se\n1 4 1 8\ndirect\n0.500001 0.500000 0.499999 Zn\n0.623879 0.125374 0.125374 Cr\n0.125375 0.623878 0.125374 Cr\n0.125374 0.125374 0.623878 Cr\n0.125374 0.125374 0.125374 Cr\n0.750001 0.750000 0.749999 Cd\n0.329885 0.890038 0.890037 Se\n0.890039 0.329884 0.890037 Se\n0.890039 0.890038 0.329883 Se\n0.890039 0.890038 0.890037 Se\n0.906073 0.364642 0.364641 Se\n0.364643 0.906072 0.364641 Se\n0.364643 0.364642 0.906072 Se\n0.364643 0.364642 0.364642 Se\n",
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{
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"created_at": "2022-09-04T14:38:38.829865Z",
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"structure_string": "Rb2 Al1 Hg1 Cl6\n1.0\n6.361334 0.000000 3.672719\n2.120444 5.997524 3.672719\n-0.000000 -0.000000 7.345436\nRb Al Hg Cl\n2 1 1 6\ndirect\n0.749999 0.749999 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Al\n0.499999 0.500000 0.500001 Hg\n0.774251 0.225748 0.225749 Cl\n0.225748 0.225748 0.774252 Cl\n0.225748 0.774251 0.774253 Cl\n0.225748 0.774251 0.225749 Cl\n0.774251 0.225748 0.774252 Cl\n0.774251 0.774251 0.225750 Cl\n",
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{
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"created_at": "2022-09-04T14:38:47.144978Z",
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"structure_string": "Sr2 Mn3 Bi2 O2\n1.0\n4.111699 0.105717 -10.012992\n-0.062475 4.112584 -10.012992\n-0.101480 -0.105717 10.823852\nSr Mn Bi O\n2 3 2 2\ndirect\n0.579772 0.579772 -0.000000 Sr\n0.420227 0.420228 -0.000000 Sr\n0.000000 0.000000 0.000000 Mn\n0.249999 0.749999 0.499998 Mn\n0.750000 0.250000 0.500000 Mn\n0.835116 0.835117 -0.000001 Bi\n0.164883 0.164883 -0.000000 Bi\n-0.000001 0.499999 0.499999 O\n0.500000 -0.000000 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:38:32.885815Z",
"updated_at": "2022-09-04T14:38:32.885831Z",
"structure_string": "Rb2 Ta2 Ge6 O18\n1.0\n3.558410 -6.163348 -0.000000\n3.558410 6.163348 0.000000\n0.000000 0.000000 10.294941\nRb Ta Ge O\n2 2 6 18\ndirect\n0.666667 0.333333 0.000000 Rb\n0.666667 0.333333 0.500000 Rb\n0.333333 0.666667 0.000000 Ta\n0.333333 0.666667 0.500000 Ta\n0.074978 0.785111 0.750000 Ge\n0.710134 0.925022 0.750000 Ge\n0.214889 0.289866 0.750000 Ge\n0.214889 0.925022 0.250000 Ge\n0.074978 0.289866 0.250000 Ge\n0.710134 0.785111 0.250000 Ge\n0.559772 0.659570 0.109686 O\n0.099798 0.659570 0.609686 O\n0.340430 0.440227 0.609686 O\n0.099798 0.659570 0.890314 O\n0.340430 0.440227 0.890314 O\n0.559772 0.900202 0.890314 O\n0.340429 0.900202 0.109686 O\n0.559772 0.659570 0.390314 O\n0.801646 0.732789 0.750000 O\n0.099798 0.440228 0.109686 O\n0.267211 0.068858 0.750000 O\n0.931142 0.198353 0.750000 O\n0.099798 0.440228 0.390314 O\n0.801647 0.068858 0.250000 O\n0.931142 0.732789 0.250000 O\n0.267211 0.198353 0.250000 O\n0.340429 0.900202 0.390314 O\n0.559772 0.900202 0.609686 O\n",
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{
"id": "jvasp-111736",
"created_at": "2022-09-04T14:38:41.886252Z",
"updated_at": "2022-09-04T14:38:41.886283Z",
"structure_string": "Na1 Yb1 Pd6 O8\n1.0\n5.740065 0.000000 -0.000000\n0.000000 5.740065 0.000000\n-0.000000 0.000000 5.740065\nYb Na Pd O\n1 1 6 8\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Na\n0.250771 0.000000 0.500000 Pd\n0.749228 0.000000 0.500000 Pd\n0.500000 0.250771 0.000000 Pd\n0.500000 0.749228 0.000000 Pd\n0.000000 0.500000 0.250771 Pd\n0.000000 0.500000 0.749228 Pd\n0.243914 0.243914 0.243914 O\n0.756085 0.756085 0.756085 O\n0.756085 0.756085 0.243914 O\n0.756085 0.243914 0.756085 O\n0.243914 0.243914 0.756085 O\n0.243914 0.756085 0.243914 O\n0.243914 0.756085 0.756085 O\n0.756085 0.243914 0.243914 O\n",
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}