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{
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"structure_string": "Na7 Al1 H2 C4 O12 F4\n1.0\n6.390664 -0.046922 -0.837358\n-3.389738 5.832191 -0.290671\n-0.009356 0.001844 8.860151\nNa Al H C O F\n7 1 2 4 12 4\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 -0.000000 Na\n0.500000 0.000000 -0.000000 Na\n0.274984 0.615077 0.641591 Na\n0.725014 0.384923 0.358408 Na\n0.221931 0.881763 0.357154 Na\n0.778067 0.118237 0.642846 Na\n-0.000000 0.500000 0.000000 Al\n0.240771 0.237793 0.505803 H\n0.759227 0.762206 0.494196 H\n0.712327 0.887855 0.299714 C\n0.287671 0.112145 0.700286 C\n0.795621 0.610258 0.714472 C\n0.204377 0.389742 0.285527 C\n0.286647 0.260353 0.339413 O\n0.153679 0.507864 0.373499 O\n0.846319 0.492135 0.626500 O\n0.175853 0.392498 0.135665 O\n0.824145 0.607501 0.864335 O\n0.713351 0.739647 0.660586 O\n0.648720 0.008867 0.372691 O\n0.708205 0.867803 0.156632 O\n0.205739 0.233770 0.617935 O\n0.794259 0.766229 0.382065 O\n0.351279 0.991132 0.627309 O\n0.291793 0.132196 0.843368 O\n0.154003 0.788523 0.107351 F\n0.250444 0.609729 0.891080 F\n0.749555 0.390270 0.108919 F\n0.845995 0.211477 0.892649 F\n",
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"structure_string": "Y6 Ga6 O18\n1.0\n6.091341 -0.000000 -0.000000\n-3.045670 5.275256 0.000000\n-0.000000 0.000000 11.727910\nY Ga O\n6 6 18\ndirect\n0.000000 0.000000 0.271011 Y\n0.333333 0.666668 0.230024 Y\n0.666667 0.333333 0.730024 Y\n0.333333 0.666668 0.730024 Y\n0.666667 0.333333 0.230024 Y\n0.000000 0.000000 0.771011 Y\n0.334205 0.000000 0.996750 Ga\n0.334205 0.334205 0.496749 Ga\n0.000000 0.665796 0.496749 Ga\n0.000000 0.334205 0.996750 Ga\n0.665795 0.665796 0.996750 Ga\n0.665795 1.000001 0.496749 Ga\n0.693685 0.000000 0.659466 O\n0.693685 0.693685 0.159466 O\n0.000000 0.306315 0.159466 O\n0.666667 0.333333 0.015893 O\n0.306316 1.000001 0.159466 O\n0.640079 0.000000 0.335090 O\n0.640079 0.640079 0.835090 O\n0.000000 0.359922 0.835090 O\n0.000000 0.640079 0.335090 O\n0.359921 0.359922 0.335090 O\n0.359922 1.000001 0.835090 O\n0.000000 0.000000 0.474237 O\n0.000000 0.000000 0.974237 O\n0.333333 0.666668 0.015893 O\n0.666667 0.333333 0.515893 O\n0.333333 0.666668 0.515893 O\n0.306315 0.306315 0.659466 O\n0.000000 0.693685 0.659466 O\n",
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{
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"structure_string": "Rb6 Mn6 Cl18\n1.0\n7.112998 0.000000 -0.000000\n-3.556499 6.160037 0.000000\n-0.000000 -0.000000 17.699645\nRb Mn Cl\n6 6 18\ndirect\n0.000000 0.000000 0.250000 Rb\n0.333333 0.666667 0.414311 Rb\n0.666667 0.333333 0.585689 Rb\n0.000000 0.000000 0.750000 Rb\n0.666667 0.333333 0.914311 Rb\n0.333333 0.666667 0.085689 Rb\n0.000000 0.000000 0.500000 Mn\n0.666667 0.333333 0.338615 Mn\n0.000000 0.000000 0.000000 Mn\n0.666667 0.333333 0.161385 Mn\n0.333333 0.666667 0.661384 Mn\n0.333333 0.666667 0.838615 Mn\n0.991406 0.495703 0.250000 Cl\n0.165898 0.331796 0.917773 Cl\n0.495703 0.504298 0.750000 Cl\n0.668205 0.834103 0.917773 Cl\n0.834102 0.165898 0.417773 Cl\n0.834102 0.668205 0.082227 Cl\n0.495703 0.991406 0.750000 Cl\n0.331796 0.165898 0.417773 Cl\n0.834102 0.165898 0.082227 Cl\n0.834102 0.668205 0.417773 Cl\n0.504297 0.495703 0.250000 Cl\n0.668205 0.834103 0.582227 Cl\n0.008595 0.504298 0.750000 Cl\n0.165898 0.834103 0.582227 Cl\n0.165898 0.331796 0.582227 Cl\n0.165898 0.834103 0.917773 Cl\n0.331796 0.165898 0.082227 Cl\n0.504297 0.008595 0.250000 Cl\n",
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{
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"structure_string": "Cd10 I20\n1.0\n4.286475 -0.000000 -0.000000\n-2.143237 3.712196 -0.000000\n0.000000 -0.000000 68.800205\nCd I\n10 20\ndirect\n0.333333 0.666668 0.624985 Cd\n0.666666 0.333333 0.425005 Cd\n0.000000 0.000000 0.124991 Cd\n0.000000 0.000000 0.324996 Cd\n0.666666 0.333333 0.024993 Cd\n0.333333 0.666668 0.525012 Cd\n0.000000 0.000000 0.824999 Cd\n0.000000 0.000000 0.924976 Cd\n0.666666 0.333333 0.224996 Cd\n0.666666 0.333333 0.725002 Cd\n0.333333 0.666668 0.050207 I\n0.666666 0.333333 0.550211 I\n0.333333 0.666668 0.850205 I\n0.000000 0.000000 0.699801 I\n0.000000 0.000000 0.999801 I\n0.333333 0.666668 0.250213 I\n0.333333 0.666668 0.150205 I\n0.666666 0.333333 0.299803 I\n0.666666 0.333333 0.799802 I\n0.666666 0.333333 0.899782 I\n0.000000 0.000000 0.199804 I\n0.000000 0.000000 0.599785 I\n0.333333 0.666668 0.350211 I\n0.333333 0.666668 0.750211 I\n0.666666 0.333333 0.099799 I\n0.333333 0.666668 0.950190 I\n0.333333 0.666668 0.450210 I\n0.666666 0.333333 0.650188 I\n0.000000 0.000000 0.399808 I\n0.000000 0.000000 0.499805 I\n",
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{
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"created_at": "2022-09-04T14:36:58.066733Z",
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"structure_string": "H14 C12 S2 N2\n1.0\n3.797581 0.055108 -0.599305\n-1.309218 7.979330 -3.002633\n0.083415 0.236938 9.585003\nH C S N\n14 12 2 2\ndirect\n0.831017 0.178917 0.083984 H\n0.437250 0.983894 0.704749 H\n0.937249 0.483894 0.204749 H\n0.792279 0.819658 0.481973 H\n0.292280 0.319658 0.981973 H\n0.410452 0.190228 0.133487 H\n0.672960 0.414478 0.498864 H\n0.910451 0.690228 0.633488 H\n0.851553 0.239870 0.672428 H\n0.351552 0.739870 0.172429 H\n0.217818 0.833861 0.438376 H\n0.717819 0.333861 0.938375 H\n0.331015 0.678917 0.583983 H\n0.172958 0.914478 -0.001136 H\n0.984020 0.055933 0.478810 C\n0.047310 0.903057 0.514725 C\n0.547310 0.403056 0.014726 C\n0.188642 0.750752 0.671739 C\n0.688643 0.250752 0.171739 C\n0.484019 0.555933 0.978810 C\n0.283398 0.799017 0.961495 C\n0.325014 0.724738 0.815663 C\n0.873712 0.202715 0.554561 C\n0.373710 0.702714 0.054560 C\n0.783398 0.299018 0.461495 C\n0.825015 0.224738 0.315663 C\n0.483276 0.538233 0.794287 S\n0.983276 0.038234 0.294287 S\n0.683845 0.421022 0.171515 N\n0.183845 0.921022 0.671515 N\n",
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"created_at": "2022-09-04T14:37:08.105398Z",
"updated_at": "2022-09-04T14:37:08.105425Z",
"structure_string": "Al6 Sb6 O18\n1.0\n5.672394 0.000000 0.000000\n-2.836197 4.912437 -0.000000\n0.000000 0.000000 13.070217\nAl Sb O\n6 6 18\ndirect\n0.666666 0.333333 0.265575 Al\n0.333333 0.666667 0.765576 Al\n0.666666 0.333333 0.765576 Al\n0.333333 0.666667 0.265575 Al\n0.000000 0.000000 0.729920 Al\n0.000000 0.000000 0.229920 Al\n0.297261 0.000000 0.984114 Sb\n0.297261 0.297262 0.484114 Sb\n-0.000000 0.702739 0.484114 Sb\n0.702738 0.702739 0.984114 Sb\n0.702738 0.000000 0.484114 Sb\n-0.000000 0.297262 0.984114 Sb\n-0.000000 0.473094 0.851717 O\n-0.000000 0.315778 0.195578 O\n-0.000000 0.684223 0.695578 O\n0.315777 0.315778 0.695578 O\n0.315778 0.000000 0.195578 O\n0.526906 0.000000 0.351717 O\n0.526906 0.526907 0.851717 O\n-0.000000 0.526907 0.351717 O\n0.666666 0.333333 0.527727 O\n0.473093 0.000000 0.851717 O\n0.000000 0.000000 0.364249 O\n0.000000 0.000000 0.864249 O\n0.333333 0.666667 0.027727 O\n0.684222 0.684223 0.195578 O\n0.333333 0.666667 0.527727 O\n0.666666 0.333333 0.027727 O\n0.473093 0.473094 0.351717 O\n0.684222 0.000000 0.695578 O\n",
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{
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"structure_string": "K10 Th2 F18\n1.0\n7.519690 0.033345 0.000000\n-3.399643 6.707404 0.000000\n0.000000 -0.000000 10.530216\nK Th F\n10 2 18\ndirect\n0.579036 0.420964 0.793778 K\n0.420964 0.579036 0.293778 K\n0.118605 0.399211 0.947773 K\n0.881395 0.600790 0.447773 K\n0.600790 0.881395 0.947773 K\n0.399211 0.118606 0.447773 K\n0.146621 0.348750 0.600922 K\n0.853379 0.651250 0.100921 K\n0.651250 0.853379 0.600922 K\n0.348751 0.146621 0.100921 K\n0.162973 0.837027 0.748669 Th\n0.837028 0.162973 0.248669 Th\n0.648969 0.351032 0.276127 F\n0.351032 0.648968 0.776127 F\n0.801380 0.198621 0.464512 F\n0.053532 0.499170 0.229886 F\n0.043305 0.956695 0.583134 F\n0.251469 0.748531 0.544522 F\n0.748532 0.251469 0.044521 F\n0.521408 0.478593 0.541757 F\n0.478593 0.521408 0.041757 F\n0.211687 0.153327 0.817922 F\n0.788314 0.846673 0.317922 F\n0.846673 0.788314 0.817922 F\n0.153327 0.211686 0.317922 F\n0.499170 0.053533 0.729886 F\n0.500830 0.946468 0.229886 F\n0.946468 0.500830 0.729886 F\n0.956696 0.043305 0.083134 F\n0.198620 0.801379 0.964512 F\n",
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{
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}