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{
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"results": [
{
"id": "jvasp-120162",
"created_at": "2022-09-04T14:38:44.750204Z",
"updated_at": "2022-09-04T14:38:44.750231Z",
"structure_string": "Sb2 O2 F2\n1.0\n3.901230 0.000000 0.000000\n0.000000 3.901230 -0.000000\n0.000000 0.000000 5.675357\nSb O F\n2 2 2\ndirect\n0.500000 0.000000 0.285784 Sb\n0.000000 0.500000 0.714217 Sb\n0.000000 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.000000 0.000000 F\n0.500000 0.500000 0.000000 F\n",
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},
{
"id": "jvasp-38028",
"created_at": "2022-09-04T14:38:12.376505Z",
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"structure_string": "Sb2 O2 F2\n1.0\n3.902036 0.000000 0.000000\n0.000000 3.902383 0.000000\n0.000000 0.000000 5.678840\nSb O F\n2 2 2\ndirect\n0.500000 0.000000 0.285990 Sb\n0.000000 0.500000 0.714010 Sb\n0.000000 0.000000 0.500107 O\n0.500000 0.500000 0.499893 O\n0.000000 0.000000 0.000200 F\n0.500000 0.500000 0.999800 F\n",
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},
{
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"structure_string": "Sb2 O4\n1.0\n1.818829 -3.150303 0.000000\n1.818829 3.150303 -0.000000\n-0.000000 0.000000 10.667351\nSb O\n2 4\ndirect\n0.333334 0.666667 0.750000 Sb\n0.666667 0.333334 0.250000 Sb\n0.666667 0.333334 0.425318 O\n0.333334 0.666667 0.925318 O\n0.666667 0.333334 0.074682 O\n0.333334 0.666667 0.574682 O\n",
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"formula_full": "Sb2 O4",
"formula_reduced": "SbO2",
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"spacegroup": 194
},
{
"id": "jvasp-8394",
"created_at": "2022-09-04T14:37:06.661078Z",
"updated_at": "2022-09-04T14:37:06.661105Z",
"structure_string": "Sb2 O4\n1.0\n-3.436514 -0.036515 0.043582\n1.694670 2.935120 0.571064\n-0.089337 -2.228011 -8.955804\nSb O\n2 4\ndirect\n0.002041 0.002012 0.497945 Sb\n0.002456 0.001914 -0.002094 Sb\n0.409330 0.816545 0.608936 O\n0.259964 0.517059 0.884226 O\n0.594757 0.187471 0.386948 O\n0.744776 0.486761 0.111582 O\n",
"nsites": 6,
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],
"chemical_system": "O-Sb",
"density": 5.9895783512240985,
"density_atomic": 0.07037662352317776,
"volume": 85.25558203320121,
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"formula_full": "Sb2 O4",
"formula_reduced": "SbO2",
"formula_anonymous": "AB2",
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"spacegroup": 166
},
{
"id": "jvasp-52516",
"created_at": "2022-09-04T14:38:17.314668Z",
"updated_at": "2022-09-04T14:38:17.314685Z",
"structure_string": "Sb2 O4 F2\n1.0\n1.940611 -4.645563 -0.105064\n3.418359 4.328211 -0.290687\n-0.126070 -2.721856 4.234841\nSb O F\n2 4 2\ndirect\n0.689308 0.150146 0.752785 Sb\n0.252785 0.650146 0.189308 Sb\n0.102210 0.413153 0.818367 O\n0.459049 0.399608 0.126438 O\n0.318368 0.913153 0.602209 O\n0.626438 0.899608 0.959049 O\n0.836312 0.400740 0.457962 F\n0.957961 0.900740 0.336313 F\n",
"nsites": 8,
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],
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"density": 5.6229914234055105,
"density_atomic": 0.07840470956576097,
"volume": 102.0346870016794,
"volume_molar": 7.680840594083197,
"formula_full": "Sb2 O4 F2",
"formula_reduced": "SbO2F",
"formula_anonymous": "ABC2",
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"spacegroup": 9
},
{
"id": "jvasp-22697",
"created_at": "2022-09-04T14:37:51.170794Z",
"updated_at": "2022-09-04T14:37:51.170823Z",
"structure_string": "Sb2 O4 F2\n1.0\n5.172914 -0.156860 0.158480\n-2.472630 1.427574 4.477949\n2.722301 -4.401444 0.158480\nSb O F\n2 4 2\ndirect\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Sb\n0.243197 0.746445 0.895883 O\n0.604116 0.753555 0.256803 O\n0.395883 0.246445 0.743197 O\n0.756802 0.253555 0.104117 O\n0.102867 0.250000 0.397133 F\n0.897132 0.750000 0.602867 F\n",
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"volume": 102.26079711026232,
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"formula_full": "Sb2 O4 F2",
"formula_reduced": "SbO2F",
"formula_anonymous": "ABC2",
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"spacegroup": 15
},
{
"id": "jvasp-10554",
"created_at": "2022-09-04T14:37:01.301860Z",
"updated_at": "2022-09-04T14:37:01.301880Z",
"structure_string": "Sb2 P2 O10\n1.0\n5.096677 -0.013373 -1.493411\n-1.374557 4.907839 -1.493411\n0.002852 0.003750 7.104310\nSb P O\n2 2 10\ndirect\n-0.000000 0.000000 0.500000 Sb\n0.000000 0.000000 0.000000 Sb\n0.332933 0.667067 0.250000 P\n0.667067 0.332933 0.750000 P\n0.260580 0.375475 0.093354 O\n0.624525 0.739420 0.406646 O\n0.739420 0.624526 0.906646 O\n0.375475 0.260580 0.593354 O\n0.095877 0.904123 0.750000 O\n0.904123 0.095878 0.250000 O\n0.128514 0.681433 0.368895 O\n0.318567 0.871486 0.131105 O\n0.871486 0.318568 0.631105 O\n0.681433 0.128515 0.868895 O\n",
"nsites": 14,
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"P",
"O"
],
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"density": 4.351239188525558,
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"volume": 177.63147717537467,
"volume_molar": 7.640869706834525,
"formula_full": "Sb2 P2 O10",
"formula_reduced": "SbPO5",
"formula_anonymous": "ABC5",
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"spacegroup": 15
},
{
"id": "jvasp-32420",
"created_at": "2022-09-04T14:38:06.397150Z",
"updated_at": "2022-09-04T14:38:06.397179Z",
"structure_string": "Sb2 P2 O4 F12\n1.0\n5.317889 -0.042446 1.206377\n0.752854 7.301129 0.221783\n-0.103560 0.090711 7.270997\nSb P O F\n2 2 4 12\ndirect\n0.580909 0.238869 0.749545 Sb\n0.419091 0.761130 0.250455 Sb\n0.226600 0.194427 0.168394 P\n0.773400 0.805572 0.831607 P\n0.559011 0.726457 0.968191 O\n0.784458 0.010448 0.828889 O\n0.440988 0.273542 0.031810 O\n0.215541 0.989552 0.171111 O\n0.684452 0.914145 0.244072 F\n0.315548 0.085855 0.755928 F\n0.150710 0.628195 0.219343 F\n0.849290 0.371804 0.780658 F\n0.616810 0.547490 0.304575 F\n0.236038 0.259944 0.364100 F\n0.726679 0.183295 0.495885 F\n0.026073 0.719179 0.868774 F\n0.763961 0.740056 0.635901 F\n0.383189 0.452510 0.695425 F\n0.273321 0.816705 0.504115 F\n0.973926 0.280820 0.131226 F\n",
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"elements": [
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],
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"density": 3.500286315322511,
"density_atomic": 0.0705644300072968,
"volume": 283.4289173445017,
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"formula_full": "Sb2 P2 O4 F12",
"formula_reduced": "SbP(OF3)2",
"formula_anonymous": "ABC2D6",
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"spacegroup": 2
},
{
"id": "jvasp-9408",
"created_at": "2022-09-04T14:37:12.256661Z",
"updated_at": "2022-09-04T14:37:12.256687Z",
"structure_string": "Sb2 P2 O8\n1.0\n0.000000 4.745256 -0.041581\n6.861439 0.000000 0.000000\n0.000000 -0.547570 -5.037905\nSb P O\n2 2 8\ndirect\n0.192531 0.750000 0.168138 Sb\n0.807470 0.250000 0.831862 Sb\n0.716455 0.750000 0.612308 P\n0.283546 0.250000 0.387693 P\n0.175856 0.428272 0.224503 O\n0.824145 0.928272 0.775497 O\n0.824145 0.571728 0.775497 O\n0.175856 0.071728 0.224503 O\n0.185960 0.250000 0.674693 O\n0.814040 0.750000 0.325307 O\n0.612988 0.250000 0.440164 O\n0.387013 0.750000 0.559837 O\n",
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"formula_full": "Sb2 P2 O8",
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"spacegroup": 11
},
{
"id": "jvasp-87925",
"created_at": "2022-09-04T14:35:49.670169Z",
"updated_at": "2022-09-04T14:35:49.670186Z",
"structure_string": "Sb2 Pb1 O6\n1.0\n5.386182 -0.000000 0.000000\n-2.693091 4.664570 0.000000\n-0.000000 0.000000 5.375631\nSb Pb O\n2 1 6\ndirect\n0.666667 0.333333 0.500000 Sb\n0.333333 0.666667 0.500000 Sb\n0.000000 0.000000 0.000000 Pb\n0.379045 0.379045 0.708350 O\n0.620954 0.000000 0.708350 O\n0.000000 0.620955 0.708350 O\n0.379045 0.000000 0.291650 O\n0.000000 0.379045 0.291650 O\n0.620954 0.620955 0.291650 O\n",
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"density": 6.721854544292579,
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"formula_full": "Sb2 Pb1 O6",
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"spacegroup": 162
},
{
"id": "jvasp-12499",
"created_at": "2022-09-04T14:37:34.966118Z",
"updated_at": "2022-09-04T14:37:34.966131Z",
"structure_string": "Sb2 Pb2 Cl2 O4\n1.0\n5.496436 -0.000000 -0.000000\n-0.000000 5.134622 -2.353088\n-0.000000 0.000215 6.779085\nSb Pb Cl O\n2 2 2 4\ndirect\n0.250000 0.919026 0.838054 Sb\n0.750001 0.080973 0.161946 Sb\n0.250000 0.617719 0.235438 Pb\n0.750001 0.382279 0.764562 Pb\n0.750001 0.743686 0.487373 Cl\n0.250000 0.256313 0.512626 Cl\n0.500000 0.227743 -0.000000 O\n0.000000 0.772257 -0.000000 O\n0.500000 0.772257 -0.000000 O\n0.000000 0.227743 -0.000000 O\n",
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],
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"density_atomic": 0.05226764777028,
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"formula_full": "Sb2 Pb2 Cl2 O4",
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"formula_anonymous": "ABCD2",
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"spacegroup": 63
},
{
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"created_at": "2022-09-04T14:38:55.583076Z",
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"structure_string": "Sb2 Pb2 F14\n1.0\n4.628096 -0.007450 -0.986834\n-0.526135 7.133059 -2.087868\n0.005039 -0.037733 7.659213\nSb Pb F\n2 2 14\ndirect\n0.351827 0.182919 0.282969 Sb\n0.648176 0.817082 0.717031 Sb\n0.830658 0.647424 0.203933 Pb\n0.169344 0.352577 0.796067 Pb\n0.791831 0.582476 0.599076 F\n0.208171 0.417525 0.400925 F\n0.344569 0.684997 0.774052 F\n0.655433 0.315004 0.225949 F\n0.413166 0.800952 0.475175 F\n0.586836 0.199048 0.524825 F\n0.484524 0.945810 0.168735 F\n0.112238 0.185232 0.046552 F\n0.951585 0.947282 0.659109 F\n0.048418 0.052718 0.340891 F\n0.281533 0.565222 0.093002 F\n0.718469 0.434779 0.906998 F\n0.515478 0.054190 0.831265 F\n0.887764 0.814769 0.953448 F\n",
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}
]
}