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{
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{
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"structure_string": "Ti1 H16 C9 O4\n1.0\n4.556527 -0.102920 -1.052477\n-2.181343 6.590066 -0.640428\n-0.214904 0.274289 8.627007\nTi H C O\n1 16 9 4\ndirect\n0.154655 0.655174 0.382808 Ti\n0.966116 0.221776 0.969341 H\n0.044569 0.264187 0.404342 H\n0.728853 0.958629 0.439794 H\n0.486781 0.004233 0.560280 H\n0.397931 0.038052 0.351003 H\n0.797887 0.060202 0.783787 H\n0.930784 0.303204 0.196816 H\n0.334085 0.333441 0.294472 H\n0.398563 0.230873 0.701285 H\n0.989038 0.377810 0.690409 H\n0.035819 0.563027 0.847843 H\n0.642809 0.719587 0.911865 H\n0.932667 0.904244 0.062597 H\n0.486480 0.072954 0.056804 H\n0.295889 0.919032 0.866999 H\n0.535303 0.381734 0.892645 H\n0.526237 0.992497 0.954963 C\n0.677840 0.833765 0.014432 C\n0.858462 0.456817 0.744471 C\n0.609070 0.304266 0.802814 C\n0.567879 0.720187 0.144033 C\n0.751661 0.582932 0.619793 C\n0.118476 0.351973 0.310645 C\n0.490833 0.948934 0.439831 C\n0.741370 0.144209 0.877508 C\n0.961992 0.684527 0.554690 O\n0.758503 0.644672 0.234738 O\n0.302174 0.700870 0.162479 O\n0.477147 0.588126 0.583403 O\n",
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{
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"structure_string": "Li5 Fe2 Ni5 O12\n1.0\n5.001129 0.161530 -0.103021\n2.328392 4.428993 0.103021\n-0.617912 0.986597 9.490898\nLi Fe Ni O\n5 2 5 12\ndirect\n0.154159 0.671485 0.505147 Li\n0.339030 0.830882 0.996385 Li\n0.671486 0.154159 0.994853 Li\n0.830882 0.339030 0.503615 Li\n0.911054 0.911054 0.750000 Li\n0.247498 0.247498 0.750000 Fe\n0.751474 0.751474 0.250000 Fe\n0.420123 0.420123 0.250000 Ni\n0.505921 -0.001334 0.502676 Ni\n0.580691 0.580691 0.750000 Ni\n0.084173 0.084173 0.250000 Ni\n-0.001334 0.505922 0.997324 Ni\n0.782498 0.034364 0.366433 O\n0.976302 0.221750 0.866476 O\n0.221750 0.976302 0.633524 O\n0.109453 0.395481 0.365238 O\n0.395481 0.109453 0.134762 O\n0.305774 0.509167 0.865911 O\n0.509167 0.305774 0.634089 O\n0.467397 0.723404 0.364079 O\n0.723405 0.467397 0.135921 O\n0.630633 0.848620 0.872846 O\n0.848620 0.630633 0.627154 O\n0.034364 0.782498 0.133567 O\n",
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{
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"created_at": "2022-09-04T14:37:59.816290Z",
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"structure_string": "Li1 C12\n1.0\n2.147236 -3.719121 0.000000\n2.147236 3.719121 -0.000000\n-0.000000 0.000000 6.973156\nLi C\n1 12\ndirect\n0.000000 0.000000 0.000000 Li\n0.333226 0.000000 0.266485 C\n0.666775 0.666775 0.266485 C\n0.000000 0.333226 0.266485 C\n0.666775 0.000001 0.266485 C\n0.333227 0.333227 0.266485 C\n0.000001 0.666775 0.266485 C\n0.666775 0.000001 0.733515 C\n0.333227 0.333227 0.733515 C\n0.000001 0.666775 0.733515 C\n0.333226 0.000000 0.733515 C\n0.666775 0.666775 0.733515 C\n0.000000 0.333226 0.733515 C\n",
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{
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"structure_string": "Li3 Fe2 Co2 O8\n1.0\n4.896932 -0.045092 2.823791\n-1.617481 4.639925 2.850647\n0.000304 0.035879 5.702982\nLi Fe Co O\n3 2 2 8\ndirect\n0.000000 0.500001 -0.000000 Li\n0.500000 0.000000 0.500000 Li\n0.500000 0.500001 0.500000 Li\n-0.000000 0.500001 0.500000 Fe\n0.500000 0.000000 -0.000000 Fe\n0.000000 0.000000 0.000000 Co\n-0.000000 0.000000 0.500000 Co\n0.240140 0.216088 0.018898 O\n0.237585 0.762423 0.019888 O\n0.216084 0.240145 0.524853 O\n0.240717 0.759267 0.483275 O\n0.759282 0.240734 0.516724 O\n0.783915 0.759857 0.475146 O\n0.762415 0.237578 0.980112 O\n0.759859 0.783913 0.981101 O\n",
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{
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"structure_string": "H14 C14 N2 O2\n1.0\n5.557077 -0.108467 2.119754\n2.327089 6.387731 0.820185\n-0.162061 -0.066819 7.606500\nH C N O\n14 14 2 2\ndirect\n0.475300 0.720920 0.872009 H\n0.891053 0.077535 0.123637 H\n0.391052 0.577537 0.623638 H\n0.921760 0.679561 0.702826 H\n0.835117 0.537440 0.457522 H\n0.335117 0.037440 0.957521 H\n0.933245 0.287337 0.804321 H\n0.421760 0.179560 0.202825 H\n0.414562 0.048699 0.591997 H\n0.914562 0.548697 0.091999 H\n0.348132 0.299907 0.491388 H\n0.848133 0.799904 0.991388 H\n0.975300 0.220920 0.372008 H\n0.433246 0.787335 0.304323 H\n0.355131 0.298420 0.771294 C\n0.895983 0.989848 0.251183 C\n0.395983 0.489849 0.751184 C\n0.944920 0.071666 0.389685 C\n0.444919 0.571666 0.889686 C\n0.855132 0.798420 0.271295 C\n0.954849 0.958486 0.552057 C\n0.300271 0.213605 0.621094 C\n0.864121 0.688107 0.436440 C\n0.364121 0.188108 0.936440 C\n0.913147 0.766363 0.575770 C\n0.413146 0.266362 0.075769 C\n0.800271 0.713603 0.121094 C\n0.454849 0.458486 0.052057 C\n0.528893 0.729343 0.170958 N\n0.028892 0.229344 0.670957 N\n0.509347 0.519060 0.196414 O\n0.009346 0.019062 0.696414 O\n",
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{
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"structure_string": "Li8 Mn1 O5 F1\n1.0\n5.261840 0.009645 -0.006318\n-2.137986 4.819287 0.009325\n-2.484537 -1.189485 5.063509\nLi Mn O F\n8 1 5 1\ndirect\n0.243442 0.470970 0.359016 Li\n0.122575 0.229395 0.653989 Li\n0.406001 0.886085 0.643481 Li\n0.710059 0.359517 0.008161 Li\n0.318639 0.674875 0.975808 Li\n0.578462 0.097769 0.347622 Li\n0.901859 0.795154 0.369414 Li\n0.757486 0.520037 0.653313 Li\n0.955631 0.966269 0.977690 Mn\n0.491964 0.577607 0.759280 O\n0.870227 0.108804 0.236722 O\n0.167683 0.777052 0.232434 O\n0.813148 0.204505 0.752879 O\n0.114778 0.885947 0.753918 O\n0.548041 0.446022 0.276277 F\n",
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{
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{
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