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"id": "jvasp-66209",
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{
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"structure_string": "Ba1 Zn2 Ru1\n1.0\n3.342137 0.000000 0.000000\n-0.000000 3.342550 0.000000\n0.000000 0.000000 7.408165\nBa Zn Ru\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.667168 Zn\n0.000000 0.000000 0.332832 Zn\n0.500000 0.500000 0.500000 Ru\n",
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{
"id": "jvasp-65474",
"created_at": "2022-09-04T14:35:42.554527Z",
"updated_at": "2022-09-04T14:35:42.554553Z",
"structure_string": "Ba1 Zn2 Ru1\n1.0\n3.342185 0.000000 0.000000\n0.000000 3.342185 -0.000000\n0.000000 -0.000000 7.408748\nBa Zn Ru\n1 2 1\ndirect\n0.499999 0.499999 0.000000 Ba\n0.000000 0.000000 0.667176 Zn\n0.000000 0.000000 0.332825 Zn\n0.499999 0.499999 0.500000 Ru\n",
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"density": 7.40836957814189,
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"volume": 82.75720116388833,
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{
"id": "jvasp-66039",
"created_at": "2022-09-04T14:35:52.263753Z",
"updated_at": "2022-09-04T14:35:52.263784Z",
"structure_string": "Ba4 Zr1 Ru1\n1.0\n0.000000 4.829633 4.829633\n4.829633 -0.000000 4.829633\n4.829633 4.829633 0.000000\nBa Zr Ru\n4 1 1\ndirect\n0.127127 0.624290 0.624290 Ba\n0.624290 0.624290 0.624290 Ba\n0.624290 0.127127 0.624290 Ba\n0.624290 0.624290 0.127127 Ba\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Ru\n",
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{
"id": "jvasp-12975",
"created_at": "2022-09-04T14:37:14.805982Z",
"updated_at": "2022-09-04T14:37:14.806016Z",
"structure_string": "Ba4 S6\n1.0\n5.650368 0.000000 -2.021845\n-0.723468 5.603860 -2.021845\n0.081981 0.093246 9.135458\nBa S\n4 6\ndirect\n0.953360 0.453360 0.906720 Ba\n0.203360 0.203360 0.406720 Ba\n0.552289 0.052289 0.104577 Ba\n0.802289 0.802289 0.604577 Ba\n0.962961 0.640586 0.281172 S\n0.390586 0.212962 0.781173 S\n0.390586 0.568213 0.781173 S\n0.318212 0.640586 0.281173 S\n0.000379 0.000379 0.000757 S\n0.750379 0.250379 0.500757 S\n",
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"elements": [
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"formula_full": "Ba4 S6",
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"spacegroup": 109
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{
"id": "jvasp-2088",
"created_at": "2022-09-04T14:36:12.730754Z",
"updated_at": "2022-09-04T14:36:12.730781Z",
"structure_string": "Ba2 S6\n1.0\n6.933495 0.000000 0.000000\n0.000000 6.933495 0.000000\n0.000000 0.000000 4.181344\nBa S\n2 6\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 Ba\n0.820106 0.679893 0.478582 S\n0.320106 0.820106 0.521417 S\n0.000000 0.500000 0.206705 S\n0.500000 0.000000 0.793294 S\n0.179894 0.320106 0.478582 S\n0.679893 0.179894 0.521417 S\n",
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"spacegroup": 113
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{
"id": "jvasp-1315",
"created_at": "2022-09-04T14:35:54.538791Z",
"updated_at": "2022-09-04T14:35:54.538820Z",
"structure_string": "Ba1 S1\n1.0\n3.932072 -0.000000 2.270183\n1.310691 3.707193 2.270183\n0.000000 0.000000 4.540366\nBa S\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 S\n",
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{
"id": "jvasp-2100",
"created_at": "2022-09-04T14:36:55.197473Z",
"updated_at": "2022-09-04T14:36:55.197492Z",
"structure_string": "Ba2 S4\n1.0\n4.579470 -0.000000 1.369528\n2.221502 4.672990 0.912923\n-0.000962 0.032631 8.344463\nBa S\n2 4\ndirect\n0.142109 0.250000 0.750000 Ba\n0.857891 0.750000 0.250000 Ba\n0.482936 0.300491 0.022259 S\n0.805686 0.199509 0.477741 S\n0.194314 0.800491 0.522258 S\n0.517064 0.699509 0.977741 S\n",
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"spacegroup": 15
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{
"id": "jvasp-34573",
"created_at": "2022-09-04T14:36:37.046304Z",
"updated_at": "2022-09-04T14:36:37.046320Z",
"structure_string": "Ba4 S12\n1.0\n5.071034 0.000000 0.000000\n0.000000 8.466338 0.000000\n0.000000 0.000000 10.066663\nBa S\n4 12\ndirect\n0.015678 0.500000 0.000000 Ba\n0.984321 0.000000 0.500000 Ba\n0.026680 0.000000 0.000000 Ba\n0.973319 0.500000 0.500000 Ba\n0.470428 0.245004 0.491724 S\n0.411079 0.186754 0.289512 S\n0.529571 0.254996 0.991723 S\n0.411079 0.813247 0.710487 S\n0.588920 0.686754 0.210488 S\n0.984370 0.750204 0.249544 S\n0.015629 0.250204 0.250456 S\n0.984370 0.249796 0.750456 S\n0.529571 0.745004 0.008276 S\n0.015629 0.749796 0.749544 S\n0.470428 0.754996 0.508276 S\n0.588920 0.313247 0.789512 S\n",
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{
"id": "jvasp-22458",
"created_at": "2022-09-04T14:38:32.533292Z",
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"structure_string": "Ba10 Sb6\n1.0\n5.048711 -8.744624 0.000000\n5.048711 8.744624 0.000000\n-0.000000 0.000000 7.754844\nBa Sb\n10 6\ndirect\n0.743375 0.000000 0.250000 Ba\n0.256624 0.000000 0.750000 Ba\n0.743375 0.743375 0.750000 Ba\n0.000000 0.743375 0.250000 Ba\n0.256624 0.256624 0.250000 Ba\n0.000000 0.256624 0.750000 Ba\n0.333333 0.666667 0.500000 Ba\n0.666667 0.333333 0.000000 Ba\n0.666667 0.333333 0.500000 Ba\n0.333333 0.666667 0.000000 Ba\n0.000000 0.389816 0.250000 Sb\n0.389816 0.389816 0.750000 Sb\n0.610183 0.000000 0.750000 Sb\n0.389816 0.000000 0.250000 Sb\n0.610183 0.610183 0.250000 Sb\n0.000000 0.610183 0.750000 Sb\n",
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{
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"created_at": "2022-09-04T14:37:33.659958Z",
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"structure_string": "Ba3 Sb2\n1.0\n6.451010 -0.000000 -0.000000\n-0.000000 6.451010 -0.000000\n0.000000 -0.000000 6.451010\nBa Sb\n3 2\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Sb\n",
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