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{
"id": "jvasp-34836",
"created_at": "2022-09-04T14:36:39.817884Z",
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{
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{
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"structure_string": "Li3 V2 Fe3 O10\n1.0\n4.779925 -0.213957 1.424770\n0.440525 4.614422 1.572529\n0.017264 0.278549 7.546581\nLi V Fe O\n3 2 3 10\ndirect\n0.505641 0.785864 0.407446 Li\n-0.000001 0.500000 0.500000 Li\n0.494358 0.214135 0.592555 Li\n-0.017339 0.838312 0.707961 V\n0.017337 0.161688 0.292039 V\n0.500001 -0.000000 0.000000 Fe\n0.990586 0.310750 0.893522 Fe\n0.009413 0.689249 0.106478 Fe\n0.234664 0.365030 0.043380 O\n0.773122 0.210429 0.754047 O\n0.769188 0.449049 0.342855 O\n0.230811 0.550950 0.657145 O\n0.206644 0.966525 0.858826 O\n0.765335 0.634969 0.956620 O\n0.774406 0.868156 0.544169 O\n0.225593 0.131843 0.455831 O\n0.226878 0.789570 0.245953 O\n0.793355 0.033474 0.141174 O\n",
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{
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"updated_at": "2022-09-04T14:38:06.735753Z",
"structure_string": "Li4 Cr3 Co3 Ni2 O16\n1.0\n5.637329 -0.018828 -0.064784\n-2.789239 -4.899075 0.064317\n0.105433 0.062074 -9.283759\nLi Cr Co Ni O\n4 3 3 2 16\ndirect\n0.330680 0.669300 0.891559 Li\n0.008782 0.991193 0.996490 Li\n0.012295 0.987665 0.495868 Li\n0.658863 0.341127 0.398108 Li\n0.166121 0.347346 0.210755 Cr\n0.652638 0.833870 0.210755 Cr\n0.833644 0.166330 0.707021 Cr\n0.345894 0.165528 0.715080 Co\n0.834444 0.654080 0.715079 Co\n0.170192 0.829796 0.212282 Co\n0.331870 0.668108 0.490650 Ni\n0.665380 0.334602 0.984717 Ni\n0.835592 0.164393 0.103203 O\n0.328840 0.167819 0.103340 O\n0.669919 0.330053 0.602707 O\n0.959018 0.477578 0.841075 O\n0.522401 0.040959 0.841076 O\n0.167338 0.832633 0.604313 O\n0.474941 0.970064 0.337010 O\n0.474007 0.525985 0.341189 O\n0.678292 0.836023 0.607501 O\n0.003593 0.996384 0.809984 O\n-0.004200 0.004191 0.308112 O\n0.333537 0.666445 0.096439 O\n0.519586 0.480389 0.835658 O\n0.163943 0.321669 0.607502 O\n0.029931 0.525054 0.337014 O\n0.832163 0.671143 0.103340 O\n",
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{
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"structure_string": "K2 H16 N6\n1.0\n-3.405080 -4.932264 0.000000\n3.405080 -4.932264 0.000000\n0.000000 0.000000 6.553457\nK H N\n2 16 6\ndirect\n0.062439 0.062439 0.250000 K\n0.937560 0.937560 0.750000 K\n0.521798 0.790600 0.972353 H\n0.487977 0.076910 0.939048 H\n0.579635 0.413327 0.877322 H\n0.405096 0.921713 0.758352 H\n0.921713 0.405096 0.741648 H\n0.413327 0.579635 0.622678 H\n0.790600 0.521798 0.527647 H\n0.076910 0.487977 0.560954 H\n0.512024 0.923090 0.439047 H\n0.420365 0.586672 0.377322 H\n0.594904 0.078286 0.258352 H\n0.078286 0.594904 0.241648 H\n0.586672 0.420365 0.122679 H\n0.923090 0.512024 0.060953 H\n0.209398 0.478201 0.027647 H\n0.478201 0.209398 0.472353 H\n0.949983 0.409220 0.586754 N\n0.678249 0.321749 0.000000 N\n0.050017 0.590779 0.086753 N\n0.590779 0.050017 0.413246 N\n0.321749 0.678249 0.499999 N\n0.409220 0.949983 0.913248 N\n",
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{
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"created_at": "2022-09-04T14:38:52.301522Z",
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"structure_string": "Mn3 Fe9 C4\n1.0\n4.429797 0.001323 0.070717\n-0.002509 4.950224 0.001473\n-0.009891 0.002862 6.691912\nMn Fe C\n3 9 4\ndirect\n0.337919 0.682496 0.063819 Mn\n0.158976 0.182003 0.438851 Mn\n0.655861 0.320360 0.564889 Mn\n0.843064 0.820373 0.932259 Fe\n0.675965 0.314034 0.932015 Fe\n0.824270 0.815352 0.565394 Fe\n0.326118 0.682860 0.430845 Fe\n0.173566 0.183113 0.070952 Fe\n0.839023 0.535406 0.250187 Fe\n0.660081 0.035175 0.248676 Fe\n0.162514 0.463057 0.751458 Fe\n0.341216 0.964727 0.749729 Fe\n0.063285 0.880847 0.248216 C\n0.436132 0.382108 0.253303 C\n0.937761 0.118625 0.738574 C\n0.564254 0.619450 0.760831 C\n",
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{
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"created_at": "2022-09-04T14:38:42.570304Z",
"updated_at": "2022-09-04T14:38:42.570319Z",
"structure_string": "Li3 V3 Co1 O8\n1.0\n3.263798 -0.020614 9.716512\n-1.675910 2.867215 9.698101\n-0.059193 -0.004103 14.555426\nLi V Co O\n3 3 1 8\ndirect\n-0.000061 0.506681 0.496798 Li\n0.506612 0.000039 0.496798 Li\n0.493150 0.493415 0.510183 Li\n0.000022 0.519710 0.987242 V\n0.519762 -0.000002 0.987196 V\n0.480284 0.480252 0.026679 V\n0.000037 -0.000012 -0.001613 Co\n-0.000027 0.000007 0.258933 O\n-0.000034 0.508203 0.252462 O\n0.508166 0.000004 0.252467 O\n0.000061 -0.000009 0.750445 O\n0.491809 0.491818 0.268829 O\n0.000079 0.492868 0.742583 O\n0.492974 -0.000045 0.742599 O\n0.507184 0.507091 0.728370 O\n",
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"created_at": "2022-09-04T14:37:58.637609Z",
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"structure_string": "Y1 Al3 B4 O12\n1.0\n5.731985 -0.005727 -1.470420\n-1.893893 5.410070 -1.470420\n-0.004067 -0.005727 5.917582\nY Al B O\n1 3 4 12\ndirect\n0.000000 0.000000 0.000000 Y\n-0.000000 0.555566 0.444433 Al\n0.444433 -0.000001 0.555566 Al\n0.555567 0.444433 0.000000 Al\n0.056689 0.499999 0.943310 B\n0.500000 0.499999 0.500000 B\n0.943311 0.056688 0.500000 B\n0.500001 0.943310 0.056689 B\n0.779576 0.028889 0.628142 O\n0.628143 0.779576 0.028890 O\n0.028890 0.628142 0.779576 O\n0.351500 0.648500 0.500000 O\n0.648501 0.499999 0.351500 O\n0.091368 0.908631 0.500000 O\n0.500000 0.091367 0.908631 O\n0.908633 0.499999 0.091368 O\n0.971110 0.220423 0.371857 O\n0.371858 0.971109 0.220424 O\n0.220423 0.371857 0.971109 O\n0.500000 0.351499 0.648500 O\n",
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{
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"created_at": "2022-09-04T14:38:43.823176Z",
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"structure_string": "Cd1 H6 C5 O4\n1.0\n4.140147 -0.000645 -0.000155\n-2.069610 4.468909 -1.078181\n0.000212 -0.568755 8.065015\nCd H C O\n1 6 5 4\ndirect\n0.016795 0.494192 0.237074 Cd\n0.712220 0.372428 0.549327 H\n0.638756 0.107251 0.668134 H\n0.377650 0.610982 0.667527 H\n0.833977 0.615914 0.924800 H\n0.260779 0.377303 0.806597 H\n0.025712 0.881060 0.805974 H\n0.953210 0.067031 0.458533 C\n0.836238 0.255833 0.604555 C\n0.162227 0.494148 0.737060 C\n0.074600 0.732486 0.869560 C\n0.380415 0.921302 0.015574 C\n0.137944 0.188360 0.350689 O\n0.873940 0.791089 0.453638 O\n0.577138 0.197223 0.020446 O\n0.443792 0.799994 0.123433 O\n",
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{
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"updated_at": "2022-09-04T14:38:14.004594Z",
"structure_string": "Li12 Cr2 O8\n1.0\n4.521553 -0.000633 -0.000704\n0.000898 6.678271 0.000042\n0.001382 0.000076 6.678410\nLi Cr O\n12 2 8\ndirect\n0.250009 0.965244 0.534757 Li\n0.750012 0.034741 0.465256 Li\n0.178992 0.249995 0.750000 Li\n0.678993 0.249984 0.750011 Li\n0.749995 0.465265 0.465279 Li\n0.749994 0.465290 0.034711 Li\n0.750001 0.034712 0.034732 Li\n0.249994 0.534725 0.534743 Li\n0.821009 0.749988 0.250012 Li\n0.321008 0.749992 0.250005 Li\n0.249997 0.965275 0.965292 Li\n0.249992 0.534694 0.965302 Li\n0.749978 0.749998 0.750000 Cr\n0.250020 0.249990 0.250021 Cr\n0.439804 0.249993 0.520673 O\n0.060211 0.979330 0.250003 O\n0.560211 0.749991 0.020670 O\n0.560201 0.749991 0.479342 O\n0.060205 0.520648 0.250005 O\n0.939786 0.479336 0.750013 O\n0.439784 0.249994 0.979346 O\n0.939797 0.020653 0.750012 O\n",
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"formula_full": "Li12 Cr2 O8",
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},
{
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"created_at": "2022-09-04T14:35:54.354863Z",
"updated_at": "2022-09-04T14:35:54.354882Z",
"structure_string": "Li4 Mn2 O4 F2\n1.0\n5.980833 2.304652 -0.132023\n-5.980833 2.304652 0.132023\n-3.837837 0.000000 4.074364\nLi Mn O F\n4 2 4 2\ndirect\n0.324008 0.674738 0.736947 Li\n0.325262 0.675991 0.236947 Li\n0.674737 0.324008 0.763052 Li\n0.675991 0.325262 0.263052 Li\n-0.000063 -0.000063 0.749999 Mn\n0.000063 0.000063 0.250000 Mn\n0.154123 0.846543 0.730646 O\n0.153456 0.845875 0.230647 O\n0.846543 0.154124 0.769352 O\n0.845875 0.153456 0.269353 O\n0.499994 0.499995 0.749999 F\n0.500005 0.500005 0.250000 F\n",
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{
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]
}