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{
"id": "jvasp-55661",
"created_at": "2022-09-04T14:38:06.618000Z",
"updated_at": "2022-09-04T14:38:06.618010Z",
"structure_string": "Al4 Cu2 Cl16\n1.0\n0.000000 6.361378 -0.127935\n7.344998 0.000000 0.000000\n0.000000 -0.967152 -12.074172\nAl Cu Cl\n4 2 16\ndirect\n0.810639 0.736044 0.812492 Al\n0.810639 0.763956 0.312492 Al\n0.189362 0.263956 0.187509 Al\n0.189362 0.236044 0.687509 Al\n0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.646569 -0.004976 0.362645 Cl\n0.353431 0.495024 0.137355 Cl\n0.353431 0.004976 0.637355 Cl\n0.646569 0.504976 0.862645 Cl\n0.169361 0.229446 0.361219 Cl\n0.830640 0.729446 0.138782 Cl\n0.830640 0.770554 0.638782 Cl\n0.309633 0.010294 0.113613 Cl\n0.690367 0.510294 0.386387 Cl\n0.129260 0.761068 0.896699 Cl\n0.309633 0.489706 0.613613 Cl\n0.690367 0.989706 0.886387 Cl\n0.870741 0.238932 0.103301 Cl\n0.129260 0.738932 0.396699 Cl\n0.169361 0.270554 0.861218 Cl\n0.870741 0.261068 0.603301 Cl\n",
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{
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"structure_string": "Rb2 Fe4 O7\n1.0\n5.082191 0.000072 -0.000019\n-2.541033 4.401309 0.000006\n-0.000025 -0.000007 6.766271\nRb Fe O\n2 4 7\ndirect\n0.333333 0.666649 1.000000 Rb\n0.666665 0.333314 1.000000 Rb\n-0.000001 0.999984 0.271252 Fe\n0.000001 0.999986 0.728750 Fe\n0.333333 0.666651 0.500000 Fe\n0.666666 0.333319 0.500000 Fe\n0.000000 0.652625 0.347320 O\n-0.000001 0.347344 0.652681 O\n0.000001 0.999983 0.000001 O\n0.347362 0.347348 0.347320 O\n0.652637 0.652622 0.652681 O\n0.347360 0.999984 0.652682 O\n0.652640 0.999986 0.347319 O\n",
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{
"id": "jvasp-37554",
"created_at": "2022-09-04T14:38:06.611450Z",
"updated_at": "2022-09-04T14:38:06.611460Z",
"structure_string": "Tm1 Hf1 Ir2\n1.0\n-0.000000 3.322639 3.322639\n3.322639 -0.000000 3.322639\n3.322639 3.322639 0.000000\nTm Hf Ir\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Tm\n0.250000 0.250000 0.250000 Hf\n0.000000 0.000000 0.000000 Ir\n0.500001 0.500001 0.500001 Ir\n",
"nsites": 4,
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{
"id": "jvasp-35244",
"created_at": "2022-09-04T14:38:06.606671Z",
"updated_at": "2022-09-04T14:38:06.606704Z",
"structure_string": "Al1 Cu1\n1.0\n2.997266 -0.000000 -0.000000\n0.000000 2.997266 -0.000000\n-0.000000 0.000000 2.997266\nAl Cu\n1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.500001 0.500001 0.500001 Cu\n",
"nsites": 2,
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{
"id": "jvasp-109483",
"created_at": "2022-09-04T14:38:06.604830Z",
"updated_at": "2022-09-04T14:38:06.604857Z",
"structure_string": "K1 Na2 Ir1 F6\n1.0\n5.427354 -0.000000 3.133484\n1.809118 5.116958 3.133484\n-0.000000 -0.000000 6.266969\nK Na Ir F\n1 2 1 6\ndirect\n0.500000 0.500000 0.499999 K\n0.750000 0.750000 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Ir\n0.771998 0.228002 0.228001 F\n0.228001 0.228002 0.771998 F\n0.228002 0.771999 0.771998 F\n0.228002 0.771999 0.228001 F\n0.771998 0.228002 0.771998 F\n0.771998 0.771999 0.228001 F\n",
"nsites": 10,
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{
"id": "jvasp-38590",
"created_at": "2022-09-04T14:38:06.601605Z",
"updated_at": "2022-09-04T14:38:06.601615Z",
"structure_string": "Li1 Lu1 Hg2\n1.0\n-0.000000 3.480703 3.480703\n3.480703 -0.000000 3.480703\n3.480703 3.480703 0.000000\nLi Lu Hg\n1 1 2\ndirect\n0.249999 0.249999 0.249999 Li\n0.749999 0.749999 0.749999 Lu\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 4,
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{
"id": "jvasp-12478",
"created_at": "2022-09-04T14:38:06.590511Z",
"updated_at": "2022-09-04T14:38:06.590521Z",
"structure_string": "Sr2 Zn2 Cl8\n1.0\n6.020087 -0.000001 -2.482326\n-1.023564 5.932433 -2.482327\n-0.003062 -0.003635 8.533630\nSr Zn Cl\n2 2 8\ndirect\n0.875001 0.625000 0.750000 Sr\n0.125000 0.375000 0.250000 Sr\n0.625001 0.875000 0.250000 Zn\n0.375001 0.125001 0.750000 Zn\n0.716837 0.364858 0.914685 Cl\n0.864858 0.697849 0.414685 Cl\n0.283165 0.635143 0.085315 Cl\n0.450174 0.783165 0.585315 Cl\n0.549828 0.216836 0.414685 Cl\n0.802153 0.950173 0.085315 Cl\n0.135143 0.302152 0.585315 Cl\n0.197849 0.049828 0.914685 Cl\n",
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"formula_full": "Sr2 Zn2 Cl8",
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"formula_anonymous": "ABC4",
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"spacegroup": 88
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{
"id": "jvasp-52091",
"created_at": "2022-09-04T14:38:06.590063Z",
"updated_at": "2022-09-04T14:38:06.590094Z",
"structure_string": "Dy3 Co11 B4\n1.0\n2.500804 -4.331520 -0.000000\n2.500804 4.331520 -0.000000\n-0.000000 0.000000 9.792023\nDy Co B\n3 11 4\ndirect\n0.000000 0.000000 0.341495 Dy\n0.000000 0.000000 0.658504 Dy\n0.000000 0.000000 0.000000 Dy\n-0.000000 0.500000 0.500000 Co\n0.666666 0.333332 0.000000 Co\n0.333332 0.666666 0.000000 Co\n0.500000 -0.000000 0.200860 Co\n0.499999 0.499999 0.200860 Co\n-0.000000 0.500000 0.200860 Co\n0.500000 -0.000000 0.799139 Co\n0.499999 0.499999 0.799139 Co\n-0.000000 0.500000 0.799139 Co\n0.500000 -0.000000 0.500000 Co\n0.499999 0.499999 0.500000 Co\n0.333332 0.666666 0.348924 B\n0.666666 0.333332 0.348924 B\n0.666666 0.333332 0.651076 B\n0.333332 0.666666 0.651076 B\n",
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{
"id": "jvasp-55665",
"created_at": "2022-09-04T14:38:06.587436Z",
"updated_at": "2022-09-04T14:38:06.587464Z",
"structure_string": "As4 Cl8 F12\n1.0\n8.584784 -0.000000 0.000000\n0.000000 8.584784 -0.000000\n-0.000000 -0.000000 6.238052\nAs Cl F\n4 8 12\ndirect\n-0.000000 0.500000 0.678456 As\n0.500000 0.000000 0.321544 As\n0.000000 0.000000 0.000000 As\n0.500000 0.500000 0.000000 As\n0.046434 0.808212 0.199114 Cl\n0.808212 0.953566 0.800885 Cl\n0.453566 0.691788 0.800885 Cl\n0.308212 0.453566 0.199114 Cl\n0.191788 0.046434 0.800885 Cl\n0.691788 0.546433 0.199114 Cl\n0.953566 0.191788 0.199114 Cl\n0.546433 0.308212 0.800885 Cl\n-0.000000 0.500000 0.959956 F\n-0.000000 0.500000 0.392628 F\n0.500000 0.000000 0.607371 F\n0.923719 0.307280 0.675780 F\n0.807280 0.576280 0.675780 F\n0.192719 0.423719 0.675780 F\n0.076280 0.692719 0.675780 F\n0.576280 0.192719 0.324219 F\n0.692719 0.923719 0.324219 F\n0.307280 0.076280 0.324219 F\n0.500000 0.000000 0.040043 F\n0.423719 0.807280 0.324219 F\n",
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{
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"created_at": "2022-09-04T14:38:06.586897Z",
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"structure_string": "Zn4 C8 S8 N8\n1.0\n7.044362 -0.008263 2.511121\n-0.314024 7.647360 2.062238\n0.041248 -0.046211 10.312923\nZn C S N\n4 8 8 8\ndirect\n0.685643 0.396062 0.833457 Zn\n0.781562 0.065379 0.318900 Zn\n0.218439 0.934621 0.681100 Zn\n0.314358 0.603938 0.166543 Zn\n0.563257 0.103484 0.115296 C\n0.869095 0.703887 0.887827 C\n0.010878 0.255803 0.607917 C\n0.606261 0.424654 0.305882 C\n0.130906 0.296113 0.112173 C\n0.989123 0.744198 0.392082 C\n0.436744 0.896516 0.884704 C\n0.393740 0.575347 0.694117 C\n0.176701 0.168370 0.497092 S\n0.273954 0.680221 0.594018 S\n0.476339 0.039462 0.730994 S\n0.956849 0.882268 0.899158 S\n0.823300 0.831630 0.502908 S\n0.043151 0.117733 0.100842 S\n0.726047 0.319780 0.405981 S\n0.523661 0.960538 0.269006 S\n0.590748 0.203628 0.004272 N\n0.889484 0.318515 0.685408 N\n0.481519 0.496013 0.762870 N\n0.518482 0.503987 0.237129 N\n0.198489 0.423841 0.116907 N\n0.409253 0.796372 0.995727 N\n0.110517 0.681486 0.314591 N\n0.801512 0.576159 0.883093 N\n",
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{
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"created_at": "2022-09-04T14:38:06.585072Z",
"updated_at": "2022-09-04T14:38:06.585084Z",
"structure_string": "Nb2 Si1 Te4\n1.0\n2.975830 -0.479911 -2.170515\n-2.308536 7.952880 -1.744831\n0.825029 -0.605866 7.621678\nNb Si Te\n2 1 4\ndirect\n0.802128 0.366034 0.186389 Nb\n0.912173 0.333064 0.813051 Nb\n0.357137 0.849515 -0.000307 Si\n0.217070 0.060479 0.754262 Te\n0.497254 0.638636 0.245192 Te\n0.409987 0.555151 0.699769 Te\n0.304247 0.143921 0.299642 Te\n",
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]
}