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{
"id": "jvasp-12646",
"created_at": "2022-09-04T14:37:19.440606Z",
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"structure_string": "Mn2 S2 O8\n1.0\n4.820967 0.024819 0.000000\n-1.907293 4.427705 0.000000\n0.000000 -0.000000 6.769727\nMn S O\n2 2 8\ndirect\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.645567 0.354434 0.250000 S\n0.354434 0.645566 0.750000 S\n0.234195 0.306478 0.750000 O\n0.765806 0.693521 0.250000 O\n0.306478 0.234194 0.250000 O\n0.693522 0.765805 0.750000 O\n0.254370 0.745629 0.931017 O\n0.745631 0.254370 0.431016 O\n0.745631 0.254370 0.068984 O\n0.254370 0.745629 0.568984 O\n",
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{
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"structure_string": "Sc2 U2 S6\n1.0\n3.715073 -0.000000 -0.000000\n-1.857536 6.071055 0.000000\n0.000000 0.000000 9.137973\nSc U S\n2 2 6\ndirect\n0.500000 0.000000 0.500000 Sc\n0.500000 0.000000 0.000000 Sc\n0.750892 0.501787 0.250000 U\n0.249106 0.498214 0.750000 U\n0.857966 0.715935 0.937235 S\n0.142032 0.284066 0.062764 S\n0.142032 0.284066 0.437235 S\n0.857966 0.715935 0.562764 S\n0.583389 0.166779 0.750000 S\n0.416609 0.833222 0.250000 S\n",
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{
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"created_at": "2022-09-04T14:38:41.089785Z",
"updated_at": "2022-09-04T14:38:41.089800Z",
"structure_string": "Mg2 Mn3 Cr1 S8\n1.0\n6.264039 -0.000348 3.617320\n2.087919 5.932596 3.617425\n-0.000681 -0.000535 7.233366\nMg Mn Cr S\n2 3 1 8\ndirect\n0.873282 0.880177 0.873264 Mg\n0.126723 0.119820 0.126738 Mg\n0.500002 0.500001 0.499997 Mn\n0.499995 0.499993 0.000000 Mn\n-0.000002 0.500005 0.500003 Mn\n0.500004 -0.000001 0.500002 Cr\n0.735759 0.743936 0.735777 S\n0.264238 0.256052 0.715480 S\n0.262747 0.711754 0.262751 S\n0.715473 0.256053 0.264238 S\n0.737256 0.288244 0.737244 S\n0.284531 0.743951 0.735755 S\n0.264235 0.256056 0.264239 S\n0.735765 0.743950 0.284521 S\n",
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"formula_full": "Mg2 Mn3 Cr1 S8",
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{
"id": "jvasp-47069",
"created_at": "2022-09-04T14:38:03.484491Z",
"updated_at": "2022-09-04T14:38:03.484519Z",
"structure_string": "Li2 Mn2 Fe2 O8\n1.0\n5.760646 -0.000000 -0.000000\n2.880323 4.954497 0.042614\n2.880323 1.691675 4.656940\nLi Mn Fe O\n2 2 2 8\ndirect\n0.122223 0.127777 0.127777 Li\n0.877778 0.872222 0.872222 Li\n-0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.500000 -0.000001 0.500000 Fe\n0.500000 0.500000 -0.000000 Fe\n0.259070 0.265124 0.265124 O\n0.262632 0.259891 0.714844 O\n0.262632 0.714844 0.259891 O\n0.710680 0.265124 0.265124 O\n0.289320 0.734875 0.734875 O\n0.737368 0.740109 0.285156 O\n0.737368 0.285156 0.740108 O\n0.740930 0.734875 0.734875 O\n",
"nsites": 14,
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{
"id": "jvasp-115809",
"created_at": "2022-09-04T14:38:39.584178Z",
"updated_at": "2022-09-04T14:38:39.584189Z",
"structure_string": "Ca1 W1 O2\n1.0\n1.559988 0.900660 5.507676\n-1.559988 0.900660 5.507676\n-0.000000 -1.801319 5.507676\nCa W O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 W\n0.251060 0.251060 0.251060 O\n0.748940 0.748940 0.748940 O\n",
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{
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"created_at": "2022-09-04T14:35:55.109785Z",
"updated_at": "2022-09-04T14:35:55.109801Z",
"structure_string": "As4 Ru1 Br1\n1.0\n-0.000000 4.070579 4.070579\n4.070579 0.000000 4.070579\n4.070579 4.070579 0.000000\nAs Ru Br\n4 1 1\ndirect\n0.610942 0.167175 0.610942 As\n0.167175 0.610942 0.610942 As\n0.610942 0.610942 0.610942 As\n0.610942 0.610942 0.167175 As\n0.000000 0.000000 0.000000 Ru\n0.250000 0.250000 0.250000 Br\n",
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{
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"created_at": "2022-09-04T14:37:01.309359Z",
"updated_at": "2022-09-04T14:37:01.309372Z",
"structure_string": "Co2 P2 O8\n1.0\n5.008032 0.014478 -0.020146\n2.294744 7.309089 4.155757\n2.334975 -1.523227 4.160369\nCo P O\n2 2 8\ndirect\n0.196043 0.253254 0.301379 Co\n0.801379 0.753254 0.696043 Co\n0.183947 0.625476 0.067091 P\n0.567091 0.125476 0.683947 P\n0.071947 0.745494 0.291315 O\n0.293309 0.457113 0.216716 O\n0.267455 0.187910 0.945953 O\n0.484231 0.112717 0.429093 O\n0.445952 0.687910 0.767455 O\n0.791315 0.245494 0.571948 O\n0.929094 0.612717 0.984231 O\n0.716716 0.957113 0.793309 O\n",
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"formula_full": "Co2 P2 O8",
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"spacegroup": 9
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{
"id": "jvasp-9422",
"created_at": "2022-09-04T14:37:13.246725Z",
"updated_at": "2022-09-04T14:37:13.246740Z",
"structure_string": "Er1 Al8 Fe4\n1.0\n4.662308 0.000000 1.902847\n2.331154 6.130881 0.951424\n0.014453 0.000000 6.627744\nEr Al Fe\n1 8 4\ndirect\n0.000000 0.000000 0.000000 Er\n0.338953 0.661046 0.661046 Al\n-0.000001 0.338953 0.661046 Al\n-0.000001 0.661046 0.338953 Al\n0.661046 0.338953 0.338954 Al\n0.279387 0.220613 0.220613 Al\n0.499999 0.779387 0.220613 Al\n0.499999 0.220613 0.779387 Al\n0.720612 0.779387 0.779387 Al\n-0.000000 -0.000000 0.500000 Fe\n0.500000 -0.000000 0.500000 Fe\n-0.000000 0.500000 -0.000000 Fe\n0.500000 0.500000 0.000000 Fe\n",
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{
"id": "jvasp-107355",
"created_at": "2022-09-04T14:36:58.172503Z",
"updated_at": "2022-09-04T14:36:58.172523Z",
"structure_string": "Ce1 U1 O4\n1.0\n3.837385 0.000000 0.000000\n0.000000 3.837385 0.000000\n0.000000 0.000000 5.479592\nCe U O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500001 0.500001 0.500000 U\n0.500001 0.000000 0.737908 O\n-0.000000 0.500001 0.262092 O\n0.500001 0.000000 0.262092 O\n-0.000000 0.500001 0.737908 O\n",
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},
{
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"created_at": "2022-09-04T14:38:18.548430Z",
"updated_at": "2022-09-04T14:38:18.548450Z",
"structure_string": "Ca2 Al4 B4 O14\n1.0\n4.789528 -0.005649 15.138763\n2.332962 4.182929 15.138763\n-0.009633 -0.005649 15.878337\nCa Al B O\n2 4 4 14\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Ca\n0.286102 0.286102 0.286101 Al\n0.786102 0.786102 0.786101 Al\n0.713899 0.713898 0.713898 Al\n0.213898 0.213898 0.213898 Al\n0.634470 0.634469 0.634469 B\n0.865531 0.865531 0.865530 B\n0.365531 0.365531 0.365530 B\n0.134469 0.134469 0.134469 B\n0.250000 0.250000 0.250000 O\n0.436475 0.097746 0.872059 O\n0.902254 0.127941 0.563525 O\n0.597747 0.936474 0.372059 O\n0.063526 0.627941 0.402253 O\n0.936475 0.372059 0.597746 O\n0.372060 0.597746 0.936474 O\n0.127941 0.563526 0.902253 O\n0.563526 0.902254 0.127940 O\n0.627941 0.402253 0.063525 O\n0.402254 0.063525 0.627940 O\n0.872060 0.436474 0.097746 O\n0.097746 0.872059 0.436474 O\n0.750001 0.750000 0.749999 O\n",
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{
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"structure_string": "Nb1 Co1 Pb2 O6\n1.0\n4.833628 -0.000000 2.790696\n1.611210 4.557189 2.790696\n0.000000 -0.000000 5.581393\nNb Co Pb O\n1 1 2 6\ndirect\n0.000000 0.000000 0.000000 Nb\n0.500000 0.500000 0.500000 Co\n0.250000 0.250000 0.250000 Pb\n0.750000 0.750000 0.750000 Pb\n0.744224 0.255777 0.255777 O\n0.255777 0.744224 0.744223 O\n0.255777 0.744224 0.255777 O\n0.744224 0.255777 0.744223 O\n0.255777 0.255777 0.744223 O\n0.744224 0.744224 0.255777 O\n",
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{
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"created_at": "2022-09-04T14:36:13.908188Z",
"updated_at": "2022-09-04T14:36:13.908215Z",
"structure_string": "Cr1 Sb1 O4\n1.0\n3.125880 0.000000 0.000000\n0.000000 4.606912 -0.051891\n0.000000 -0.051891 4.606912\nCr Sb O\n1 1 4\ndirect\n0.500000 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Sb\n0.000000 0.691378 0.691378 O\n0.500000 0.197340 0.802660 O\n0.500000 0.802660 0.197340 O\n0.000000 0.308621 0.308621 O\n",
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}
]
}