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{
"id": "jvasp-9739",
"created_at": "2022-09-04T14:37:07.586261Z",
"updated_at": "2022-09-04T14:37:07.586286Z",
"structure_string": "Zn2 Ga4 O8\n1.0\n5.161953 0.000000 2.980256\n1.720651 4.866737 2.980256\n-0.000000 -0.000000 5.960510\nZn Ga O\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Zn\n0.874999 0.875001 0.875001 Zn\n0.500000 0.500000 0.000001 Ga\n0.500000 0.500000 0.500001 Ga\n-0.000000 0.500000 0.500000 Ga\n0.500000 0.000000 0.500001 Ga\n0.738478 0.738479 0.738479 O\n0.261522 0.261522 0.715436 O\n0.261521 0.715436 0.261522 O\n0.715435 0.261522 0.261523 O\n0.738478 0.284565 0.738479 O\n0.284564 0.738479 0.738479 O\n0.261522 0.261522 0.261522 O\n0.738478 0.738479 0.284566 O\n",
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"structure_string": "Li5 Re1 O6\n1.0\n4.950251 0.005627 -0.859568\n-1.314149 4.173728 -2.510683\n0.002548 -0.000476 5.044851\nLi Re O\n5 1 6\ndirect\n0.000000 0.333695 0.666305 Li\n0.000000 0.666305 0.333696 Li\n0.500000 0.500000 0.500000 Li\n0.500000 0.178185 0.821814 Li\n0.500000 0.821815 0.178186 Li\n0.000000 0.000000 0.000000 Re\n0.235703 0.386941 0.077751 O\n0.235703 0.077751 0.386941 O\n0.764297 0.922250 0.613059 O\n0.764297 0.613059 0.922249 O\n0.771065 0.230877 0.230877 O\n0.228935 0.769123 0.769123 O\n",
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{
"id": "jvasp-45533",
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"structure_string": "Y4 Fe4 O12\n1.0\n0.000000 5.605176 -0.000097\n5.209361 0.000000 0.000000\n0.000000 -0.000420 -7.458264\nY Fe O\n4 4 12\ndirect\n0.075777 0.979477 0.250001 Y\n0.424223 0.479477 0.749999 Y\n0.575778 0.520523 0.250001 Y\n0.924223 0.020523 0.749999 Y\n0.500000 0.000000 0.500000 Fe\n-0.000000 0.500000 0.500000 Fe\n0.000000 0.500000 0.000000 Fe\n0.500000 0.000000 0.000000 Fe\n0.971477 0.398893 0.250000 O\n0.528524 0.898893 0.750000 O\n0.695664 0.306327 0.949070 O\n0.804337 0.806327 0.050930 O\n0.195662 0.193673 0.550929 O\n0.804339 0.806327 0.449071 O\n0.304337 0.693673 0.050930 O\n0.195664 0.193673 0.949070 O\n0.028524 0.601107 0.750000 O\n0.695662 0.306327 0.550929 O\n0.304338 0.693673 0.449071 O\n0.471477 0.101107 0.250000 O\n",
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{
"id": "jvasp-50790",
"created_at": "2022-09-04T14:37:07.603389Z",
"updated_at": "2022-09-04T14:37:07.603413Z",
"structure_string": "Ca3 P2 O8\n1.0\n5.184151 0.010919 0.013358\n-2.227082 4.722647 0.012835\n-0.018602 -0.028428 7.194582\nCa P O\n3 2 8\ndirect\n0.347882 0.735504 0.249970 Ca\n0.006323 0.023201 0.978304 Ca\n0.006303 0.023165 0.521674 Ca\n0.351914 0.646116 0.749979 P\n0.643740 0.346403 0.250038 P\n0.681729 0.796636 0.749995 O\n0.253642 0.320801 0.749981 O\n0.235751 0.724326 0.930912 O\n0.235784 0.724331 0.569035 O\n0.705281 0.210779 0.421677 O\n0.705301 0.210675 0.078446 O\n0.803022 0.679900 0.249997 O\n0.311828 0.270071 0.249997 O\n",
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"formula_full": "Ca3 P2 O8",
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{
"id": "jvasp-9697",
"created_at": "2022-09-04T14:37:07.610127Z",
"updated_at": "2022-09-04T14:37:07.610151Z",
"structure_string": "Sm4 Cu4 S8\n1.0\n0.000000 6.440344 0.007069\n7.131200 0.000000 0.000000\n0.000000 -0.891927 -6.778079\nSm Cu S\n4 4 8\ndirect\n0.808178 0.951038 0.199117 Sm\n0.191821 0.451038 0.300883 Sm\n0.191821 0.048962 0.800883 Sm\n0.808178 0.548962 0.699117 Sm\n0.422864 0.661757 0.949755 Cu\n0.577135 0.338243 0.050245 Cu\n0.577134 0.161757 0.550245 Cu\n0.422865 0.838243 0.449755 Cu\n0.079521 0.726042 0.999393 S\n0.920478 0.226042 0.500607 S\n0.920478 0.273958 0.000607 S\n0.079521 0.773958 0.499393 S\n0.406800 0.113151 0.218815 S\n0.406799 0.386849 0.718815 S\n0.593199 0.886849 0.781185 S\n0.593200 0.613151 0.281185 S\n",
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{
"id": "jvasp-8336",
"created_at": "2022-09-04T14:37:07.610560Z",
"updated_at": "2022-09-04T14:37:07.610576Z",
"structure_string": "Ca1 Fe2 N2\n1.0\n3.504624 0.000000 0.000000\n0.000000 3.504624 0.000000\n0.000000 0.000000 5.951454\nCa Fe N\n1 2 2\ndirect\n0.000000 0.000000 0.500000 Ca\n0.499999 0.499999 0.812251 Fe\n0.499999 0.499999 0.187749 Fe\n0.499999 0.000000 0.215681 N\n0.000000 0.499999 0.784318 N\n",
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{
"id": "jvasp-10097",
"created_at": "2022-09-04T14:37:07.623999Z",
"updated_at": "2022-09-04T14:37:07.624022Z",
"structure_string": "Tc2 Ag2 O8\n1.0\n5.308105 0.003615 -0.001637\n-0.004044 5.308206 -0.001444\n-2.650235 -2.654436 5.806406\nTc Ag O\n2 2 8\ndirect\n0.375010 0.624996 0.250004 Tc\n0.624990 0.375003 0.749996 Tc\n0.874986 0.125010 0.249999 Ag\n0.125013 0.874989 0.750001 Ag\n0.154784 0.306672 0.082071 O\n0.306674 0.427275 0.582070 O\n0.775383 0.154805 0.582076 O\n0.427308 0.775402 0.082088 O\n0.572691 0.224597 0.917912 O\n0.224617 0.845194 0.417925 O\n0.693326 0.572725 0.417931 O\n0.845215 0.693327 0.917930 O\n",
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{
"id": "jvasp-34651",
"created_at": "2022-09-04T14:37:07.631379Z",
"updated_at": "2022-09-04T14:37:07.631399Z",
"structure_string": "K2 Sb2 F12\n1.0\n5.241645 -0.000000 0.000000\n-0.000000 5.241645 0.000000\n0.000000 0.000000 9.725017\nK Sb F\n2 2 12\ndirect\n0.500000 0.500000 0.750000 K\n0.500000 0.500000 0.250000 K\n0.000000 0.000000 0.000000 Sb\n0.000000 0.000000 0.500000 Sb\n0.816169 0.183832 0.138470 F\n0.816169 0.816169 0.361530 F\n0.260256 0.739744 0.500000 F\n0.183832 0.183832 0.361530 F\n0.183832 0.816169 0.861530 F\n0.816169 0.816169 0.638471 F\n0.260256 0.260256 0.000000 F\n0.739744 0.260256 0.500000 F\n0.183832 0.183832 0.638471 F\n0.183832 0.816169 0.138470 F\n0.816169 0.183832 0.861530 F\n0.739744 0.739744 0.000000 F\n",
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{
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"created_at": "2022-09-04T14:37:07.651867Z",
"updated_at": "2022-09-04T14:37:07.651892Z",
"structure_string": "K1 N1 O2\n1.0\n-4.409933 -0.220390 -0.070079\n-0.402459 -4.398202 -0.073411\n1.125710 1.078095 3.707755\nK N O\n1 1 2\ndirect\n0.008997 0.009050 0.042454 K\n0.489947 0.489879 0.447545 N\n0.399093 0.769919 0.601859 O\n0.769962 0.399154 0.602144 O\n",
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{
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"created_at": "2022-09-04T14:37:11.628054Z",
"updated_at": "2022-09-04T14:37:11.628079Z",
"structure_string": "Al1 Cu1 S2\n1.0\n-1.796380 3.111421 -0.000000\n-3.592759 -0.000000 0.000000\n-1.796380 1.037140 6.033725\nAl Cu S\n1 1 2\ndirect\n0.002150 0.002150 0.993552 Al\n0.857488 0.857489 0.427535 Cu\n0.733596 0.733596 0.799213 S\n0.253766 0.253766 0.238702 S\n",
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{
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"structure_string": "Ag2 N2 O4\n1.0\n-3.810464 2.071006 -0.936099\n-0.328008 -4.338226 -0.870169\n0.052030 0.175072 6.728053\nAg N O\n2 2 4\ndirect\n0.752161 0.442981 0.715133 Ag\n0.727847 0.037027 0.284866 Ag\n0.378151 0.001962 0.749506 N\n0.252455 0.628645 0.250493 N\n0.968560 0.597181 0.147446 O\n0.254745 0.407618 0.344534 O\n0.063084 0.910212 0.655466 O\n0.449735 0.821114 0.852553 O\n",
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{
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"created_at": "2022-09-04T14:37:07.622009Z",
"updated_at": "2022-09-04T14:37:07.622038Z",
"structure_string": "Li4 Mn2 O4\n1.0\n4.269628 0.253098 2.010545\n0.989864 4.597696 0.466096\n0.194394 0.126608 5.125849\nLi Mn O\n4 2 4\ndirect\n0.948395 0.250001 0.603214 Li\n0.448394 0.750001 0.603215 Li\n0.551604 0.250001 0.396788 Li\n0.051603 0.750001 0.396788 Li\n0.749999 0.750001 0.000001 Mn\n0.250000 0.250000 0.000001 Mn\n0.145053 0.500001 0.709901 O\n0.645050 0.000005 0.709901 O\n0.354946 -0.000000 0.290101 O\n0.854949 0.499996 0.290102 O\n",
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}
]
}