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{
"id": "jvasp-120746",
"created_at": "2022-09-04T14:38:49.192434Z",
"updated_at": "2022-09-04T14:38:49.192458Z",
"structure_string": "Li4 Ni4 P4 O16\n1.0\n4.803175 -0.000000 0.000000\n0.000000 6.209487 0.000000\n-0.000000 -0.000000 9.384885\nLi Ni P O\n4 4 4 16\ndirect\n0.500001 0.500000 -0.000000 Li\n0.500001 0.000000 -0.000000 Li\n-0.000000 0.500000 0.500000 Li\n0.000000 0.000000 0.500000 Li\n0.963892 0.250000 0.139784 Ni\n0.463892 0.750000 0.360216 Ni\n0.536109 0.250000 0.639783 Ni\n0.036109 0.750000 0.860216 Ni\n0.031904 0.250000 0.814946 P\n0.531904 0.750000 0.685053 P\n0.468097 0.250000 0.314947 P\n0.968097 0.750000 0.185053 P\n0.157761 0.049832 0.888953 O\n0.612350 0.750000 0.847193 O\n0.112350 0.250000 0.652806 O\n0.657762 0.950168 0.611046 O\n0.657762 0.549832 0.611046 O\n0.210568 0.750000 0.664905 O\n0.789433 0.250000 0.335094 O\n0.842240 0.549832 0.111046 O\n0.342239 0.450168 0.388954 O\n0.887651 0.750000 0.347193 O\n0.387651 0.250000 0.152807 O\n0.842240 0.950168 0.111046 O\n0.157761 0.450168 0.888953 O\n0.289432 0.750000 0.164905 O\n0.342239 0.049832 0.388954 O\n0.710569 0.250000 0.835094 O\n",
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{
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"formula_full": "Li4 Co4 P4 O16",
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{
"id": "jvasp-120744",
"created_at": "2022-09-04T14:38:49.088078Z",
"updated_at": "2022-09-04T14:38:49.088088Z",
"structure_string": "Li4 Cr3 Co1 P4 O16\n1.0\n6.150023 -0.000000 0.000000\n0.000000 4.716065 0.035811\n-0.000000 0.004678 10.066731\nLi Cr Co P O\n4 3 1 4 16\ndirect\n0.255755 0.991452 0.004039 Li\n0.744245 0.991452 0.004039 Li\n0.741248 0.501505 0.493146 Li\n0.258751 0.501505 0.493146 Li\n0.500000 0.538429 0.782914 Cr\n-0.000000 0.457464 0.218891 Cr\n-0.000000 0.048601 0.717089 Cr\n0.500000 0.967629 0.278447 Co\n0.500000 0.084740 0.595559 P\n0.500000 0.418753 0.092437 P\n-0.000000 0.580165 0.906095 P\n-0.000000 0.916444 0.405783 P\n0.700615 0.219175 0.668089 O\n-0.000000 0.244687 0.398665 O\n-0.000000 0.253251 0.899687 O\n0.297133 0.283311 0.161957 O\n0.702866 0.283311 0.161957 O\n0.500000 0.294947 0.947836 O\n-0.000000 0.693534 0.051435 O\n0.201958 0.778323 0.338639 O\n0.201993 0.717735 0.837150 O\n0.500000 0.743892 0.090290 O\n0.500000 0.757213 0.602460 O\n0.798042 0.778323 0.338639 O\n0.299385 0.219175 0.668089 O\n-0.000000 0.809365 0.553359 O\n0.798006 0.717735 0.837150 O\n0.500000 0.207896 0.453004 O\n",
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{
"id": "jvasp-120743",
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"structure_string": "Mn4 Ni1 O8\n1.0\n5.109946 -0.013723 2.810532\n1.921294 4.735015 2.810532\n0.093911 0.063059 5.720200\nMn Ni O\n4 1 8\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n-0.000000 0.499999 0.000000 Mn\n0.500000 0.000000 -0.000000 Mn\n0.500000 0.500000 -0.000000 Ni\n0.736783 0.736783 0.797163 O\n0.722732 0.236897 0.776176 O\n0.236896 0.722732 0.776176 O\n0.250718 0.250719 0.772086 O\n0.749282 0.749281 0.227913 O\n0.763104 0.277268 0.223823 O\n0.277268 0.763103 0.223824 O\n0.263217 0.263217 0.202837 O\n",
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{
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"created_at": "2022-09-04T14:38:52.148025Z",
"updated_at": "2022-09-04T14:38:52.148039Z",
"structure_string": "Li1 Mn5 Cu2 O12\n1.0\n4.987137 -0.078421 -0.320065\n2.169687 4.491119 0.320064\n-0.009678 0.015697 9.041874\nLi Mn Cu O\n1 5 2 12\ndirect\n0.920451 0.920452 0.750000 Li\n0.082705 0.082705 0.250000 Mn\n0.425049 0.425050 0.250000 Mn\n0.575653 0.575654 0.750000 Mn\n0.512188 -0.003835 0.511088 Mn\n-0.003836 0.512189 0.988912 Mn\n0.243983 0.243984 0.750000 Cu\n0.752890 0.752891 0.250000 Cu\n0.665807 0.799795 0.885597 O\n0.762486 0.415835 0.141812 O\n0.748517 0.089989 0.358678 O\n0.415835 0.762486 0.358188 O\n0.552008 0.262581 0.635882 O\n0.089989 0.748518 0.141322 O\n0.262580 0.552009 0.864118 O\n0.316600 0.188418 0.122236 O\n0.915882 0.269694 0.860776 O\n0.188417 0.316600 0.377764 O\n0.269693 0.915883 0.639223 O\n0.799794 0.665808 0.614403 O\n",
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{
"id": "jvasp-120741",
"created_at": "2022-09-04T14:38:48.997546Z",
"updated_at": "2022-09-04T14:38:48.997576Z",
"structure_string": "Li4 Al2 Co2 O8\n1.0\n5.396822 0.000000 0.000000\n-0.000000 3.909894 3.075736\n-0.000000 -0.001630 8.026132\nLi Al Co O\n4 2 2 8\ndirect\n0.331956 0.255190 0.247357 Li\n0.832287 0.506522 0.995731 Li\n0.668044 0.255190 0.747357 Li\n0.167712 0.506521 0.495731 Li\n0.670133 0.750914 0.246312 Al\n0.329867 0.750914 0.746312 Al\n0.167268 0.999211 0.000140 Co\n0.832732 0.999211 0.500140 Co\n0.679449 0.381852 0.256842 O\n0.181570 0.642123 0.978748 O\n0.166528 0.086722 0.514916 O\n0.644320 0.866063 0.737057 O\n0.320551 0.381852 0.756841 O\n0.818429 0.642123 0.478748 O\n0.833471 0.086722 0.014916 O\n0.355680 0.866063 0.237057 O\n",
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"formula_full": "Li4 Al2 Co2 O8",
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{
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"created_at": "2022-09-04T14:38:54.210344Z",
"updated_at": "2022-09-04T14:38:54.210372Z",
"structure_string": "Li2 V4 F14\n1.0\n7.168145 -0.202836 1.994732\n3.693368 6.146745 1.994732\n0.042229 0.023109 5.162968\nLi V F\n2 4 14\ndirect\n0.507716 0.492285 0.250000 Li\n0.492285 0.507716 0.750000 Li\n0.660103 0.011765 0.732164 V\n0.011765 0.660103 0.232164 V\n0.339898 0.988235 0.267835 V\n0.988236 0.339898 0.767835 V\n0.148857 0.078032 0.013512 F\n0.078032 0.148857 0.513512 F\n0.578345 0.805570 0.005185 F\n0.805570 0.578344 0.505185 F\n-0.000000 0.500000 -0.000000 F\n0.500001 -0.000000 0.500000 F\n0.851144 0.921968 0.986487 F\n0.421656 0.194430 -0.005186 F\n0.364255 0.720516 0.464531 F\n0.921968 0.851144 0.486487 F\n0.279485 0.635746 0.035468 F\n0.635746 0.279485 0.535468 F\n0.194430 0.421656 0.494814 F\n0.720516 0.364254 0.964531 F\n",
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],
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{
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"created_at": "2022-09-04T14:37:19.430678Z",
"updated_at": "2022-09-04T14:37:19.430694Z",
"structure_string": "Ti2 Cl2 O2\n1.0\n3.256701 -0.000000 0.000000\n0.000000 4.016336 0.000000\n0.000000 0.000000 7.511040\nTi Cl O\n2 2 2\ndirect\n0.750000 0.250000 0.094273 Ti\n0.250000 0.750001 0.905727 Ti\n0.750000 0.750001 0.667691 Cl\n0.250000 0.250000 0.332309 Cl\n0.250000 0.250000 0.921662 O\n0.750000 0.750001 0.078338 O\n",
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{
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"created_at": "2022-09-04T14:38:52.084950Z",
"updated_at": "2022-09-04T14:38:52.084977Z",
"structure_string": "La1 Nd1 Co10\n1.0\n3.932560 0.000000 0.000000\n0.000000 4.999845 -0.000000\n-0.000000 0.000000 8.679056\nLa Nd Co\n1 1 10\ndirect\n0.000000 -0.000020 -0.000000 La\n-0.000000 0.499985 0.500000 Nd\n-0.000000 0.999981 0.331306 Co\n-0.000000 0.499988 0.833915 Co\n-0.000000 0.499988 0.166086 Co\n-0.000000 0.999981 0.668694 Co\n0.500000 -0.000017 0.500000 Co\n0.500000 0.499985 0.000000 Co\n0.500000 0.254426 0.254383 Co\n0.500000 0.745542 0.745617 Co\n0.500000 0.745542 0.254383 Co\n0.500000 0.254426 0.745617 Co\n",
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{
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"structure_string": "Mg4 Co4 Si4 O16\n1.0\n4.788804 -0.000000 0.000000\n0.000000 6.022726 0.000000\n-0.000000 -0.000000 10.174634\nMg Co Si O\n4 4 4 16\ndirect\n0.500000 0.000000 0.500000 Mg\n-0.000000 0.500000 -0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.489262 0.750000 0.776644 Co\n0.010738 0.750000 0.276644 Co\n0.510737 0.250000 0.223355 Co\n0.989262 0.250000 0.723355 Co\n0.429936 0.250000 0.904389 Si\n0.070064 0.250000 0.404389 Si\n0.570063 0.750000 0.095610 Si\n0.929936 0.750000 0.595610 Si\n0.280119 0.469114 0.835322 O\n0.219881 0.030886 0.335322 O\n0.280119 0.030886 0.835322 O\n0.219881 0.469114 0.335322 O\n0.719881 0.530887 0.164678 O\n0.780118 0.969114 0.664678 O\n0.224739 0.250000 0.551987 O\n0.231204 0.750000 0.088112 O\n0.775261 0.750000 0.448013 O\n0.724738 0.750000 0.948012 O\n0.768795 0.250000 0.911888 O\n0.731204 0.250000 0.411888 O\n0.780118 0.530887 0.664678 O\n0.268795 0.750000 0.588112 O\n0.275261 0.250000 0.051987 O\n0.719881 0.969114 0.164678 O\n",
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{
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"created_at": "2022-09-04T14:38:52.038048Z",
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"structure_string": "Nb6 Cd1 S8\n1.0\n9.746263 -0.000000 0.000000\n-4.873132 8.440511 0.000000\n0.000000 0.000000 3.374004\nNb Cd S\n6 1 8\ndirect\n0.112024 0.626312 0.249972 Nb\n0.514289 0.887976 0.249972 Nb\n0.373687 0.485711 0.249972 Nb\n0.887976 0.373687 0.750027 Nb\n0.485711 0.112024 0.750027 Nb\n0.626312 0.514289 0.750027 Nb\n0.000000 0.000000 0.499999 Cd\n0.666667 0.333333 0.249690 S\n0.333333 0.666667 0.750309 S\n0.285829 0.941396 0.249817 S\n0.655568 0.714171 0.249817 S\n0.058604 0.344432 0.249817 S\n0.714171 0.058604 0.750182 S\n0.344432 0.285829 0.750182 S\n0.941396 0.655568 0.750182 S\n",
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],
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{
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"created_at": "2022-09-04T14:38:53.202949Z",
"updated_at": "2022-09-04T14:38:53.202976Z",
"structure_string": "P2 H2 Pb2 O8\n1.0\n6.641227 -0.000000 0.000000\n0.000000 4.662531 0.512688\n-0.000000 -0.052660 5.796091\nP H Pb O\n2 2 2 8\ndirect\n0.792454 0.488581 0.247404 P\n0.207547 0.488581 0.747404 P\n0.475996 0.514084 0.984268 H\n0.524004 0.514084 0.484268 H\n0.206580 -0.000431 0.269493 Pb\n0.793420 -0.000431 0.769493 Pb\n0.656801 0.359526 0.067973 O\n0.650862 0.632992 0.426835 O\n0.349138 0.632992 0.926835 O\n0.343199 0.359526 0.567973 O\n0.918393 0.254929 0.387098 O\n0.922966 0.734017 0.131728 O\n0.077035 0.734017 0.631728 O\n0.081607 0.254929 0.887098 O\n",
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}
]
}