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{
"id": "jvasp-52944",
"created_at": "2022-09-04T14:36:41.134291Z",
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"structure_string": "Li4 Mo1 O5\n1.0\n4.214876 0.000789 0.000276\n-2.106593 -4.585937 -0.001827\n-2.107175 0.001412 -4.585683\nLi Mo O\n4 1 5\ndirect\n0.811336 0.412551 0.215404 Li\n0.595696 0.785460 0.411226 Li\n0.399893 0.216752 0.588331 Li\n0.184225 0.589644 0.784121 Li\n0.952614 0.001099 0.999775 Mo\n0.291526 0.365578 0.186501 O\n0.104793 0.814379 0.364242 O\n0.927042 0.187814 0.635305 O\n0.740323 0.636619 0.813047 O\n0.518478 0.001103 0.999775 O\n",
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{
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{
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"structure_string": "Li2 Mg8 H26 Os4\n1.0\n4.719351 0.000000 -0.000000\n-2.359676 4.087066 -0.000000\n0.000000 -0.000000 18.376377\nLi Mg H Os\n2 8 26 4\ndirect\n0.333322 0.666644 0.250000 Li\n0.666678 0.333356 0.750000 Li\n-0.000001 -0.000001 0.350255 Mg\n0.000001 0.000001 0.649745 Mg\n0.000001 0.000001 0.850255 Mg\n-0.000001 -0.000001 0.149745 Mg\n0.333335 0.666670 0.947444 Mg\n0.666665 0.333331 0.052556 Mg\n0.666665 0.333331 0.447444 Mg\n0.333335 0.666670 0.552556 Mg\n0.500006 0.000012 0.161625 H\n-0.000024 0.499986 0.161624 H\n0.500010 0.499986 0.338376 H\n0.500006 0.000012 0.338375 H\n-0.000024 0.499986 0.338376 H\n0.499990 0.500015 0.661624 H\n0.333332 0.666666 0.394997 H\n0.000024 0.500015 0.661624 H\n0.000005 0.000010 0.250000 H\n-0.000005 -0.000010 0.750000 H\n0.500010 0.499986 0.161624 H\n0.666667 0.333335 0.605003 H\n0.499994 -0.000012 0.661625 H\n0.000024 0.500015 0.838376 H\n0.163733 0.836265 0.051208 H\n0.499990 0.500015 0.838376 H\n0.672531 0.836265 0.051208 H\n0.163734 0.327468 0.051208 H\n0.666667 0.333335 0.894997 H\n0.327468 0.163736 0.948792 H\n0.836266 0.672533 0.948793 H\n0.836266 0.163736 0.948792 H\n0.327468 0.163736 0.551208 H\n0.836266 0.672533 0.551208 H\n0.836266 0.163736 0.551208 H\n0.672531 0.836265 0.448792 H\n0.163734 0.327468 0.448793 Os\n0.163733 0.836265 0.448792 Os\n0.499994 -0.000012 0.838375 Os\n0.333332 0.666666 0.105003 Os\n",
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"formula_full": "Li2 Mg8 H26 Os4",
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{
"id": "jvasp-44746",
"created_at": "2022-09-04T14:38:11.235176Z",
"updated_at": "2022-09-04T14:38:11.235212Z",
"structure_string": "Li2 Fe1 Cu1 O4\n1.0\n0.000000 5.565729 0.356670\n2.782359 0.000000 0.000000\n0.000000 -2.182376 -4.717244\nLi Fe Cu O\n2 1 1 4\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 -0.000000 Li\n-0.000000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Cu\n0.787155 0.000000 0.236272 O\n0.229810 0.500000 0.321471 O\n0.212844 0.000000 0.763727 O\n0.770189 0.500000 0.678528 O\n",
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{
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"created_at": "2022-09-04T14:35:59.614177Z",
"updated_at": "2022-09-04T14:35:59.614201Z",
"structure_string": "H12 N4 O16\n1.0\n5.024245 0.000000 0.000000\n0.000000 9.219114 0.000000\n0.000000 0.000000 6.121268\nH N O\n12 4 16\ndirect\n0.704600 0.377220 0.624651 H\n0.204601 0.622780 0.375349 H\n0.204601 0.877220 0.875349 H\n0.704600 0.122780 0.124651 H\n0.596081 0.327620 0.118175 H\n0.398951 0.229808 -0.023226 H\n0.096082 0.672379 -0.118175 H\n0.898950 0.770191 0.023226 H\n0.096082 0.827620 0.381825 H\n0.898950 0.729808 0.523226 H\n0.596081 0.172379 0.618175 H\n0.398951 0.270192 0.476774 H\n0.537436 0.910069 0.708186 N\n0.037437 0.089931 0.291814 N\n0.037437 0.410069 0.791814 N\n0.537436 0.589930 0.208186 N\n0.019056 0.771017 0.896509 O\n0.519056 0.228982 0.103492 O\n0.024975 0.219170 0.344238 O\n0.524974 0.780830 0.655762 O\n0.524974 0.719169 0.155762 O\n0.024975 0.280830 0.844238 O\n0.213896 0.003970 0.351988 O\n0.713896 -0.003970 0.648012 O\n0.213896 0.496029 0.851988 O\n0.850658 0.034886 0.157393 O\n0.350658 0.965114 0.842607 O\n0.350658 0.534886 0.342607 O\n0.850658 0.465114 0.657393 O\n0.019056 0.728982 0.396509 O\n0.713896 0.503970 0.148012 O\n0.519056 0.271017 0.603492 O\n",
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{
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"created_at": "2022-09-04T14:37:11.944856Z",
"updated_at": "2022-09-04T14:37:11.944882Z",
"structure_string": "Li1 V1 O2\n1.0\n1.446949 2.506189 0.000000\n-1.446949 2.506189 0.000000\n0.000000 1.670792 4.886679\nLi V O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 V\n0.245265 0.245265 0.264207 O\n0.754735 0.754735 0.735793 O\n",
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},
{
"id": "jvasp-46151",
"created_at": "2022-09-04T14:38:09.862038Z",
"updated_at": "2022-09-04T14:38:09.862047Z",
"structure_string": "Li4 Ti2 Co4 O10\n1.0\n5.092901 -0.056962 0.039138\n1.875855 4.741536 0.014208\n2.596950 -0.015152 7.325934\nLi Ti Co O\n4 2 4 10\ndirect\n0.101687 0.504188 0.793503 Li\n0.202727 0.001122 0.598673 Li\n0.491726 0.487463 0.001499 Li\n0.798951 0.002317 0.405426 Li\n0.704969 0.493647 0.611543 Ti\n0.010515 -0.003360 -0.002241 Ti\n0.873913 0.512799 0.202866 Co\n0.600405 0.000209 0.791549 Co\n0.313102 0.505358 0.389495 Co\n0.400122 0.983358 0.216671 Co\n0.939443 0.736307 0.595826 O\n0.145570 0.755448 0.185804 O\n0.044641 0.264837 0.407890 O\n0.347564 0.745951 0.800880 O\n0.546619 0.746274 0.417043 O\n0.663732 0.237570 0.185868 O\n0.236917 0.237453 0.005959 O\n0.467545 0.267067 0.597898 O\n0.753948 0.770575 -0.004792 O\n0.855888 0.251435 0.798639 O\n",
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{
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"created_at": "2022-09-04T14:36:21.792736Z",
"updated_at": "2022-09-04T14:36:21.792763Z",
"structure_string": "Li1 V1 O2\n1.0\n2.787062 0.006615 4.347760\n1.278850 2.476348 4.347760\n0.010833 0.006615 5.164360\nLi V O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.499998 0.500002 0.500000 V\n0.245268 0.245270 0.245269 O\n0.754729 0.754735 0.754731 O\n",
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{
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"created_at": "2022-09-04T14:36:21.778301Z",
"updated_at": "2022-09-04T14:36:21.778322Z",
"structure_string": "Li2 V1 O2 F1\n1.0\n-0.000004 -2.014115 -2.014074\n-2.066642 2.185754 -4.199899\n4.133213 0.000033 -0.000025\nLi V O F\n2 1 2 1\ndirect\n0.692543 0.614936 0.307426 Li\n0.307461 0.385062 0.692573 Li\n0.000000 0.000000 0.000000 V\n0.346369 0.307254 0.153614 O\n0.653635 0.692744 0.846386 O\n0.000001 0.000000 0.500000 F\n",
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{
"id": "jvasp-44730",
"created_at": "2022-09-04T14:38:12.537490Z",
"updated_at": "2022-09-04T14:38:12.537510Z",
"structure_string": "Li4 Fe5 Co3 O16\n1.0\n5.622854 0.005379 0.033894\n-2.800426 4.857887 0.000283\n-0.039746 -0.023645 9.076609\nLi Fe Co O\n4 5 3 16\ndirect\n0.663554 0.331783 0.105568 Li\n0.997469 0.998741 0.001622 Li\n0.999459 0.999748 0.503673 Li\n0.333363 0.666696 0.607571 Li\n0.668219 0.334125 0.513416 Fe\n0.343579 0.171799 0.788849 Fe\n0.332487 0.666252 0.008291 Fe\n0.170126 0.825241 0.286558 Fe\n0.170127 0.344912 0.286557 Fe\n0.659146 0.829586 0.287926 Co\n0.827697 0.657784 0.788253 Co\n0.827697 0.169934 0.788253 Co\n0.664068 0.832045 0.901750 O\n0.169949 0.834787 0.898402 O\n0.333693 0.666860 0.397866 O\n0.476815 0.519797 0.158580 O\n0.476811 0.957038 0.158578 O\n0.334731 0.167380 0.398357 O\n0.520834 0.042098 0.657459 O\n0.958772 0.479393 0.659101 O\n0.836543 0.172231 0.400179 O\n0.002123 0.001076 0.193334 O\n0.002209 0.001110 0.694543 O\n0.665431 0.332731 0.897166 O\n0.037765 0.518897 0.154244 O\n0.836544 0.664344 0.400183 O\n0.520829 0.478757 0.657463 O\n0.169946 0.335178 0.898406 O\n",
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{
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"created_at": "2022-09-04T14:38:32.019774Z",
"updated_at": "2022-09-04T14:38:32.019805Z",
"structure_string": "Li7 Mn4 Co1 O12\n1.0\n2.830087 0.000000 0.000000\n-0.000000 5.604808 1.257131\n-0.000000 -0.058381 13.391044\nLi Mn Co O\n7 4 1 12\ndirect\n0.500000 0.834581 0.822624 Li\n0.500000 0.490457 0.524851 Li\n0.500000 0.175673 0.155310 Li\n0.000000 0.164982 0.664734 Li\n0.000000 0.819334 0.352298 Li\n0.000000 0.509327 0.980914 Li\n0.000000 0.665818 0.669705 Li\n0.000000 0.009258 0.990275 Mn\n0.500000 0.985971 0.516863 Mn\n0.000000 0.329797 0.342589 Mn\n0.500000 0.664668 0.160904 Mn\n0.500000 0.358243 0.811327 Co\n0.500000 0.778772 0.991213 O\n0.500000 0.406082 0.673392 O\n0.500000 0.094475 0.349348 O\n0.000000 0.095977 0.847277 O\n0.000000 0.769566 0.504242 O\n0.000000 0.434176 0.165314 O\n0.500000 0.921276 0.652918 O\n0.500000 0.563567 0.335645 O\n0.500000 0.227717 0.001134 O\n0.000000 0.223045 0.506760 O\n0.000000 0.903269 0.149054 O\n0.000000 0.573978 0.831303 O\n",
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{
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"created_at": "2022-09-04T14:38:26.217049Z",
"updated_at": "2022-09-04T14:38:26.217083Z",
"structure_string": "Li8 Mn6 O14\n1.0\n4.838036 0.014506 1.205296\n1.134024 6.745360 0.811577\n-0.008598 0.009997 7.603250\nLi Mn O\n8 6 14\ndirect\n0.707826 0.060323 0.568821 Li\n0.837607 0.762665 0.285505 Li\n0.577770 0.354997 0.849204 Li\n0.422229 0.645004 0.150797 Li\n0.292174 0.939678 0.431180 Li\n0.162392 0.237336 0.714496 Li\n-0.000000 0.500000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.646834 0.235364 0.222392 Mn\n0.353165 0.764637 0.777609 Mn\n0.783047 0.925514 0.927492 Mn\n0.073228 0.370852 0.359188 Mn\n0.926771 0.629149 0.640813 Mn\n0.216953 0.074487 0.072509 Mn\n0.392177 0.220052 0.450472 O\n0.531878 0.926741 0.164189 O\n0.668514 0.639742 0.873127 O\n0.975168 0.103440 0.317371 O\n0.845513 0.378961 0.599076 O\n0.900076 0.211662 0.981283 O\n0.024831 0.896561 0.682630 O\n0.331485 0.360259 0.126874 O\n0.468122 0.073260 0.835812 O\n0.773635 0.491580 0.255632 O\n0.607823 0.779949 0.549529 O\n0.226364 0.508421 0.744369 O\n0.154487 0.621040 0.400925 O\n0.099924 0.788339 0.018718 O\n",
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"formula_full": "Li8 Mn6 O14",
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]
}