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{
"id": "jvasp-9673",
"created_at": "2022-09-04T14:38:08.967393Z",
"updated_at": "2022-09-04T14:38:08.967428Z",
"structure_string": "Zn2 Sb4 O8\n1.0\n5.900729 -0.000000 -3.097959\n-1.626468 5.672145 -3.097959\n-0.272800 -0.362020 6.648978\nZn Sb O\n2 4 8\ndirect\n0.375000 0.625001 0.750000 Zn\n0.625000 0.375000 0.250000 Zn\n0.000000 0.000000 0.500000 Sb\n-0.000000 0.500000 0.000000 Sb\n0.500000 0.000000 0.500000 Sb\n0.000000 0.000000 0.000000 Sb\n0.750353 0.751083 0.500707 O\n0.750377 0.249648 0.999294 O\n0.248917 0.249648 0.999294 O\n0.249647 0.248918 0.499294 O\n0.249647 0.750378 0.499294 O\n0.249623 0.750353 0.000706 O\n0.750353 0.249623 0.500706 O\n0.751083 0.750353 0.000706 O\n",
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{
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"structure_string": "Zn2 Sb4 O8\n1.0\n3.379191 -0.000000 -0.000000\n-1.689595 5.041301 -0.000000\n0.000000 0.000000 14.585931\nZn Sb O\n2 4 8\ndirect\n0.417395 0.834792 0.750000 Zn\n0.582603 0.165208 0.250000 Zn\n0.862783 0.725569 0.062703 Sb\n0.137215 0.274431 0.937297 Sb\n0.862783 0.725569 0.437297 Sb\n0.137215 0.274431 0.562703 Sb\n0.220476 0.440953 0.434028 O\n0.779522 0.559047 0.565972 O\n0.779522 0.559047 0.934028 O\n0.220476 0.440953 0.065972 O\n0.034708 0.069417 0.250000 O\n-0.034708 -0.069417 0.750000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n",
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{
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"updated_at": "2022-09-04T14:37:16.427856Z",
"structure_string": "Zn2 Sb4 O8\n1.0\n6.623773 0.249461 0.205568\n3.527926 5.611626 0.205568\n3.551746 2.050601 5.799976\nZn Sb O\n2 4 8\ndirect\n0.125000 0.625000 0.625001 Zn\n0.625000 0.125000 0.625001 Zn\n0.970590 0.970590 0.029410 Sb\n0.279410 0.279410 0.220591 Sb\n0.625000 0.625000 0.125000 Sb\n0.625000 0.625000 0.625001 Sb\n0.383493 0.383493 0.418686 O\n0.380784 0.885972 0.366624 O\n0.383493 0.383492 0.814331 O\n0.885972 0.380784 0.366624 O\n0.364029 0.869216 0.883378 O\n0.869216 0.364028 0.883378 O\n0.866507 0.866507 0.435671 O\n0.866507 0.866507 0.831316 O\n",
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{
"id": "jvasp-10032",
"created_at": "2022-09-04T14:37:07.982889Z",
"updated_at": "2022-09-04T14:37:07.982915Z",
"structure_string": "Zn2 Sb4 O8\n1.0\n6.623730 0.249562 0.205658\n3.527992 5.611538 0.205658\n3.551826 2.050648 5.800108\nZn Sb O\n2 4 8\ndirect\n0.125000 0.625000 0.625001 Zn\n0.625000 0.125000 0.625001 Zn\n0.970587 0.970588 0.029413 Sb\n0.279412 0.279412 0.220588 Sb\n0.625000 0.625000 0.125000 Sb\n0.625000 0.625000 0.625001 Sb\n0.383494 0.383494 0.418677 O\n0.380784 0.885969 0.366624 O\n0.383494 0.383494 0.814336 O\n0.885968 0.380785 0.366624 O\n0.364031 0.869215 0.883377 O\n0.869215 0.364031 0.883377 O\n0.866505 0.866506 0.435666 O\n0.866506 0.866506 0.831324 O\n",
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{
"id": "jvasp-10164",
"created_at": "2022-09-04T14:37:14.758159Z",
"updated_at": "2022-09-04T14:37:14.758179Z",
"structure_string": "Zn2 Sb4 O8\n1.0\n3.315330 -0.002165 -0.002015\n-1.653570 6.382929 -0.585428\n-1.653171 -2.005513 9.917621\nZn Sb O\n2 4 8\ndirect\n0.490340 0.733674 0.238913 Zn\n0.490076 0.233264 0.739201 Zn\n0.694619 0.302983 0.078060 Sb\n0.694061 0.802750 0.577713 Sb\n0.286331 0.164184 0.400400 Sb\n0.285839 0.663960 0.900053 Sb\n0.668072 0.562904 0.765453 O\n0.668525 0.063335 0.265671 O\n0.311901 0.903607 0.712444 O\n0.312406 0.404027 0.212659 O\n0.119394 0.340690 0.890190 O\n0.119546 0.840820 0.390240 O\n0.861145 0.626256 0.087931 O\n0.860860 0.126113 0.587870 O\n",
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{
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"created_at": "2022-09-04T14:38:07.462415Z",
"updated_at": "2022-09-04T14:38:07.462434Z",
"structure_string": "Zn2 Sb4 O8\n1.0\n3.247586 0.000338 0.666480\n1.347696 10.024553 1.672961\n0.351042 0.994027 6.535292\nZn Sb O\n2 4 8\ndirect\n0.251629 0.238899 0.266268 Zn\n0.750695 0.739219 0.766791 Zn\n0.616705 0.078079 0.696987 Sb\n0.116205 0.577686 0.197281 Sb\n0.886096 0.400433 0.835782 Sb\n0.385657 0.900033 0.336070 Sb\n0.902494 0.765436 0.437168 O\n0.402965 0.265683 0.936610 O\n0.599336 0.712436 0.096450 O\n0.099868 0.212680 0.595902 O\n0.229059 0.890196 0.659336 O\n0.729380 0.390240 0.159147 O\n0.773344 0.087916 0.373726 O\n0.272893 0.587869 0.873918 O\n",
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"formula_full": "Zn2 Sb4 O8",
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{
"id": "jvasp-102644",
"created_at": "2022-09-04T14:36:41.656226Z",
"updated_at": "2022-09-04T14:36:41.656246Z",
"structure_string": "Zn2 Se1 S1\n1.0\n3.945998 0.000000 0.000000\n0.000000 3.945998 0.000000\n-0.000000 0.000000 5.580006\nZn Se S\n2 1 1\ndirect\n0.500000 0.000000 0.763108 Zn\n-0.000000 0.500000 0.236892 Zn\n0.000000 0.000000 0.500000 Se\n0.500000 0.500000 -0.000000 S\n",
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"volume": 86.88571663070361,
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"formula_full": "Zn2 Se1 S1",
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"formula_anonymous": "ABC2",
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"spacegroup": 115
},
{
"id": "jvasp-8047",
"created_at": "2022-09-04T14:37:07.444453Z",
"updated_at": "2022-09-04T14:37:07.444488Z",
"structure_string": "Zn2 Se2\n1.0\n2.016787 -3.493176 0.000000\n2.016787 3.493176 -0.000000\n0.000000 -0.000000 6.637972\nZn Se\n2 2\ndirect\n0.333334 0.666668 0.999295 Zn\n0.666668 0.333334 0.499295 Zn\n0.333334 0.666668 0.625705 Se\n0.666668 0.333334 0.125705 Se\n",
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"spacegroup": 186
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{
"id": "jvasp-29593",
"created_at": "2022-09-04T14:36:42.837490Z",
"updated_at": "2022-09-04T14:36:42.837511Z",
"structure_string": "Zn2 Se2\n1.0\n4.132762 0.000000 0.000000\n0.000000 4.132762 0.000000\n-0.000000 0.000000 5.367541\nZn Se\n2 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.500000 0.275223 Se\n0.500000 0.000000 0.724776 Se\n",
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{
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"created_at": "2022-09-04T14:38:07.198404Z",
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"structure_string": "Zn2 Se2 O8\n1.0\n4.848038 0.000000 0.000000\n0.000000 4.952747 0.000000\n0.000000 0.000000 6.010726\nZn Se O\n2 2 8\ndirect\n0.964665 0.068099 0.000000 Zn\n0.464665 0.931902 0.500000 Zn\n0.522217 0.651332 0.000000 Se\n0.022217 0.348669 0.500000 Se\n0.624641 0.334357 0.000000 O\n0.182325 0.685601 0.000000 O\n0.667115 0.824070 0.215669 O\n0.167114 0.175930 0.284332 O\n0.682325 0.314399 0.500000 O\n0.124641 0.665643 0.500000 O\n0.167114 0.175930 0.715669 O\n0.667115 0.824070 0.784332 O\n",
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{
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"created_at": "2022-09-04T14:35:51.603083Z",
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"structure_string": "Zn2 Se2 O8\n1.0\n2.774222 4.091991 0.000000\n-2.774222 4.091991 0.000000\n0.000000 0.000000 6.570057\nZn Se O\n2 2 8\ndirect\n0.000000 0.000000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.353118 0.353118 0.250000 Se\n0.646882 0.646882 0.750000 Se\n0.277005 0.770334 0.750000 O\n0.229666 0.722995 0.250000 O\n0.246519 0.246519 0.035699 O\n0.246519 0.246519 0.464301 O\n0.753481 0.753481 0.535699 O\n0.753481 0.753481 0.964302 O\n0.722995 0.229666 0.250000 O\n0.770334 0.277005 0.750000 O\n",
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{
"id": "jvasp-98655",
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"structure_string": "Zn2 Si2 Ag4 O8\n1.0\n5.525459 0.000000 -0.074736\n0.000000 5.487073 0.000000\n-0.042900 0.000000 6.991418\nZn Si Ag O\n2 2 4 8\ndirect\n0.495836 0.808980 0.502225 Zn\n0.995836 0.191019 0.002225 Zn\n0.994392 0.687641 0.254411 Si\n0.494392 0.312359 0.754412 Si\n0.981304 0.199772 0.512347 Ag\n0.481304 0.800228 0.012347 Ag\n0.498569 0.298626 0.243674 Ag\n-0.001431 0.701373 0.743675 Ag\n0.201755 0.289983 0.790895 O\n0.701755 0.710017 0.290895 O\n0.146063 0.795250 0.441915 O\n0.646063 0.204750 0.941915 O\n0.571913 0.600406 0.723727 O\n0.562167 0.156290 0.559803 O\n0.071913 0.399594 0.223727 O\n0.062167 0.843710 0.059803 O\n",
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],
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"volume": 211.95239152904253,
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"formula_full": "Zn2 Si2 Ag4 O8",
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}
]
}