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{
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{
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{
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"structure_string": "Mn1 Fe1 O2\n1.0\n3.056080 -0.000000 0.000000\n0.000000 3.056080 0.000000\n-0.000000 -0.000000 4.326760\nMn Fe O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 O\n0.500000 0.500000 -0.000000 O\n",
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{
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"structure_string": "Li4 Cr2 P4 H3 O16\n1.0\n4.867442 0.018344 0.150473\n1.838870 7.350657 0.069131\n-0.009702 -0.021248 8.196049\nLi Cr P H O\n4 2 4 3 16\ndirect\n0.119677 0.324919 0.346412 Li\n0.391840 0.151069 0.875489 Li\n0.598380 0.839511 0.119761 Li\n0.887819 0.680277 0.642184 Li\n0.006501 0.500903 0.994262 Cr\n0.494854 0.002428 0.496650 Cr\n0.631392 0.240823 0.152670 P\n0.879208 0.251358 0.668288 P\n0.112660 0.746625 0.328884 P\n0.374429 0.766148 0.842751 P\n0.965726 0.012137 0.009974 H\n0.444207 0.513648 0.428223 H\n0.536409 0.498645 0.654454 H\n0.655219 0.143477 0.691710 O\n0.855348 0.350456 0.173579 O\n0.716721 0.451354 0.592483 O\n0.626739 0.657399 0.941471 O\n0.480616 0.811938 0.671303 O\n0.757238 0.053406 0.060199 O\n0.351639 0.842970 0.308612 O\n0.991241 0.700329 0.169917 O\n0.517925 0.192578 0.319720 O\n0.389829 0.340907 0.044721 O\n0.236962 0.549063 0.416437 O\n0.166142 0.642645 0.814584 O\n0.006710 0.296061 0.825979 O\n0.103242 0.175454 0.535206 O\n0.246780 0.941602 0.940185 O\n0.883430 0.839961 0.453786 O\n",
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{
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"updated_at": "2022-09-04T14:38:45.743655Z",
"structure_string": "Na6 Co8 O16\n1.0\n2.877903 -0.000000 0.000000\n0.000000 9.799973 0.000000\n-0.000000 -0.000000 10.747050\nNa Co O\n6 8 16\ndirect\n-0.000000 0.353268 0.500000 Na\n-0.000000 0.695792 0.500000 Na\n-0.000000 0.006776 -0.000000 Na\n0.499999 0.646732 -0.000000 Na\n0.499999 0.993224 0.500000 Na\n0.499999 0.304208 -0.000000 Na\n0.499999 0.125759 0.753209 Co\n0.499999 0.125759 0.246791 Co\n0.499999 0.623809 0.255645 Co\n0.499999 0.623809 0.744355 Co\n-0.000000 0.376191 0.755645 Co\n-0.000000 0.874240 0.253209 Co\n-0.000000 0.874240 0.746792 Co\n-0.000000 0.376191 0.244355 Co\n0.499999 0.462793 0.843168 O\n0.499999 0.793487 0.348858 O\n0.499999 0.954646 0.161043 O\n0.499999 0.293014 0.665145 O\n0.499999 0.793487 0.651142 O\n0.499999 0.954646 0.838957 O\n-0.000000 0.045354 0.338957 O\n-0.000000 0.706986 0.834855 O\n-0.000000 0.045354 0.661043 O\n-0.000000 0.206513 0.151142 O\n-0.000000 0.537207 0.656832 O\n-0.000000 0.706986 0.165145 O\n-0.000000 0.206513 0.848858 O\n0.499999 0.462793 0.156832 O\n-0.000000 0.537207 0.343168 O\n0.499999 0.293014 0.334855 O\n",
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{
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"created_at": "2022-09-04T14:35:47.783510Z",
"updated_at": "2022-09-04T14:35:47.783538Z",
"structure_string": "Mn2 Be1 Co1\n1.0\n-1.718160 1.718160 3.422641\n1.718160 -1.718160 3.422641\n1.718160 1.718160 -3.422641\nMn Be Co\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.250000 0.750000 0.500000 Mn\n0.500000 0.500000 0.000000 Be\n0.750000 0.250000 0.500000 Co\n",
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{
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"created_at": "2022-09-04T14:38:42.783750Z",
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"structure_string": "H10 C16 S2 N2 O2\n1.0\n3.611943 -0.008078 0.133957\n1.006654 8.722844 2.979385\n-0.013755 -0.135482 10.213688\nH C S N O\n10 16 2 2 2\ndirect\n0.217100 0.664234 0.812363 H\n0.243237 0.006173 0.153382 H\n0.676245 0.771200 0.637707 H\n0.676243 0.271200 0.137706 H\n0.693537 0.612387 0.479512 H\n0.243238 0.506173 0.653382 H\n0.593329 0.183383 0.491697 H\n0.593328 0.683383 0.991698 H\n0.217099 0.164234 0.312363 H\n0.693536 0.112388 0.979512 H\n0.477473 0.800424 0.305595 C\n0.333608 0.955499 0.259924 C\n0.333610 0.455500 0.759923 C\n0.317017 0.042763 0.348052 C\n0.317017 0.542763 0.848052 C\n0.454444 0.084504 0.683832 C\n0.454442 0.584504 0.183833 C\n0.477474 0.300425 0.805595 C\n0.580188 0.732113 0.444154 C\n0.452902 0.477507 0.983184 C\n0.580188 0.232114 0.944154 C\n0.569857 0.820779 0.533175 C\n0.569855 0.320779 0.033175 C\n0.572851 0.234234 0.692179 C\n0.572849 0.734234 0.192180 C\n0.452902 0.977507 0.483184 C\n0.264304 0.460461 0.314187 S\n0.264304 0.960461 0.814187 S\n0.505956 0.582427 0.053177 N\n0.505958 0.082427 0.553177 N\n0.741902 0.811817 0.092100 O\n0.741903 0.311817 0.592100 O\n",
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{
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"structure_string": "Nb1 H1 O2\n1.0\n3.190116 0.000000 0.000000\n0.000000 3.190116 0.000000\n0.000000 -0.000000 3.971506\nNb H O\n1 1 2\ndirect\n0.500001 0.500001 0.520538 Nb\n0.000000 0.000000 0.861788 H\n0.000000 0.000000 0.611584 O\n0.500001 0.500001 0.016091 O\n",
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{
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"created_at": "2022-09-04T14:37:14.694112Z",
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"structure_string": "Li2 Ni2 P2 O8\n1.0\n2.798257 4.100936 0.000000\n-2.798257 4.100936 0.000000\n0.000000 0.000000 6.164035\nLi Ni P O\n2 2 2 8\ndirect\n0.500001 0.500001 0.000000 Li\n0.500001 0.500001 0.500000 Li\n0.183350 0.183350 0.250000 Ni\n0.816651 0.816651 0.750001 Ni\n0.139908 0.139908 0.750001 P\n0.860093 0.860093 0.250000 P\n0.243604 0.802159 0.750001 O\n0.197842 0.756397 0.250000 O\n0.251186 0.251186 0.548199 O\n0.748815 0.748815 0.048198 O\n0.251186 0.251186 0.951802 O\n0.748815 0.748815 0.451802 O\n0.756397 0.197842 0.250000 O\n0.802159 0.243604 0.750001 O\n",
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{
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"structure_string": "Fe1 Co2 O6\n1.0\n5.490232 -2.786453 -0.050868\n0.000000 -1.471979 2.406583\n-3.064170 -3.864810 -2.363898\nFe Co O\n1 2 6\ndirect\n0.333333 0.333332 0.333333 Fe\n0.000291 -0.000145 -0.001070 Co\n0.666376 0.666810 0.667737 Co\n0.018756 0.490622 0.231635 O\n0.345726 0.827135 0.564251 O\n0.686150 0.156923 0.895492 O\n0.320941 0.839528 0.102416 O\n0.647910 0.176044 0.435033 O\n0.980516 0.509740 0.771176 O\n",
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{
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"structure_string": "Li4 Mn2 V6 O16\n1.0\n5.778700 0.000311 -0.000032\n2.889117 4.892008 -1.668965\n0.000091 0.001266 10.009169\nLi Mn V O\n4 2 6 16\ndirect\n0.320251 0.359536 0.559925 Li\n0.820211 0.359535 0.059925 Li\n0.745697 0.508695 0.751444 Li\n0.245610 0.508695 0.251441 Li\n0.188609 0.622792 0.937137 Mn\n0.688603 0.622791 0.437136 Mn\n0.499341 0.001281 0.010198 V\n0.734438 0.001261 0.245195 V\n0.264373 0.001333 0.245250 V\n0.234308 0.001329 0.745239 V\n0.764312 0.001263 0.745207 V\n-0.000642 0.001281 0.510199 V\n0.120977 0.222210 0.626344 O\n0.338945 0.788252 0.375727 O\n0.838942 0.788301 0.875740 O\n0.872756 0.788303 0.375741 O\n0.372805 0.788254 0.875728 O\n0.620932 0.222232 0.126355 O\n0.156807 0.222212 0.126347 O\n0.620807 0.758407 0.126396 O\n0.388877 0.222240 0.358420 O\n0.888885 0.222238 0.858419 O\n0.892420 0.215209 0.369204 O\n0.392367 0.215209 0.869204 O\n0.605869 0.788265 0.642665 O\n0.120789 0.758407 0.626395 O\n0.656830 0.222233 0.626358 O\n0.105872 0.788265 0.142665 O\n",
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}