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{
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{
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"created_at": "2022-09-04T14:38:19.969854Z",
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"structure_string": "Ba1 Nd1 Fe1 Co1 O6\n1.0\n3.882192 -0.000000 0.000000\n0.000000 3.882192 0.000000\n-0.000000 -0.000000 7.702214\nBa Nd Fe Co O\n1 1 1 1 6\ndirect\n0.000000 0.000000 0.997026 Ba\n0.000000 0.000000 0.504789 Nd\n0.500000 0.500000 0.253584 Fe\n0.500000 0.500000 0.749422 Co\n0.500000 0.500000 0.006264 O\n-0.000000 0.500000 0.724625 O\n0.500000 0.000000 0.724625 O\n-0.000000 0.500000 0.270974 O\n0.500000 0.000000 0.270974 O\n0.500000 0.500000 0.497713 O\n",
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{
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"created_at": "2022-09-04T14:37:31.502296Z",
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"structure_string": "Te4 Mo1 W3 Se2 S2\n1.0\n3.410953 0.000000 -0.000000\n-1.705476 2.954000 -0.000008\n-0.000000 -0.000102 38.510892\nTe Mo W Se S\n4 1 3 2 2\ndirect\n0.333352 0.666706 0.330580 Te\n0.333353 0.666710 0.706176 Te\n0.333349 0.666702 0.232912 Te\n0.333349 0.666702 0.608747 Te\n0.333308 0.666620 0.093990 Mo\n0.333312 0.666627 0.469649 W\n0.666686 0.333375 0.281779 W\n0.666689 0.333380 0.657528 W\n0.666647 0.333294 0.426783 Se\n0.666648 0.333296 0.512510 Se\n0.666647 0.333295 0.055183 S\n0.666648 0.333298 0.132910 S\n",
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"structure_string": "K2 Fe1 Ni1 C6 N6\n1.0\n6.223449 -0.000000 3.593110\n2.074483 5.867524 3.593110\n-0.000000 -0.000000 7.186220\nK Fe Ni C N\n2 1 1 6 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Ni\n0.184568 0.815431 0.184569 C\n0.815431 0.184569 0.815431 C\n0.184568 0.815431 0.815432 C\n0.815431 0.815431 0.184569 C\n0.815431 0.184569 0.184569 C\n0.184569 0.184569 0.815431 C\n0.699804 0.699803 0.300196 N\n0.300196 0.699803 0.699804 N\n0.699804 0.300196 0.699804 N\n0.300196 0.699803 0.300196 N\n0.699804 0.300196 0.300196 N\n0.300196 0.300196 0.699804 N\n",
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"structure_string": "Na4 Ga2 P2 C2 O14\n1.0\n0.000000 5.139570 0.019973\n6.491386 0.000000 0.000000\n0.000000 -0.106800 -8.908029\nNa Ga P C O\n4 2 2 2 14\ndirect\n0.771060 0.506619 0.221565 Na\n0.771060 0.993382 0.221565 Na\n0.228940 0.493381 0.778435 Na\n0.228940 0.006619 0.778435 Na\n0.217673 0.250000 0.357204 Ga\n0.782327 0.750000 0.642797 Ga\n0.280484 0.750000 0.426688 P\n0.719516 0.250000 0.573312 P\n0.287296 0.250000 0.081813 C\n0.712704 0.750000 0.918187 C\n0.530321 0.750000 0.810039 O\n0.800142 0.058011 0.663984 O\n0.800142 0.441989 0.663984 O\n0.146999 0.750000 0.582016 O\n0.416173 0.250000 0.545983 O\n0.583827 0.750000 0.454018 O\n0.052107 0.250000 0.134400 O\n0.199858 0.558011 0.336016 O\n0.199858 0.941990 0.336016 O\n0.469679 0.250000 0.189961 O\n0.947892 0.750000 0.865601 O\n0.656145 0.750000 0.054651 O\n0.853001 0.250000 0.417985 O\n0.343854 0.250000 0.945350 O\n",
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{
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"structure_string": "Li2 Mn2 P2 H4 O10\n1.0\n4.685520 0.000000 0.000000\n0.000000 5.744080 0.000000\n0.000000 0.000000 7.951426\nLi Mn P H O\n2 2 2 4 10\ndirect\n0.089075 0.000000 0.448810 Li\n0.589075 0.500000 0.551190 Li\n0.027704 0.000000 0.977739 Mn\n0.527704 0.500000 0.022261 Mn\n0.593733 0.000000 0.236300 P\n0.093732 0.500000 0.763701 P\n0.066594 0.636419 0.212917 H\n0.566594 0.863581 0.787083 H\n0.566594 0.136419 0.787083 H\n0.066594 0.363581 0.212917 H\n0.222388 0.714935 0.860803 O\n0.264081 0.000000 0.222744 O\n0.687985 0.000000 0.420461 O\n0.695059 0.000000 0.785144 O\n0.722388 0.214935 0.139197 O\n0.222388 0.285065 0.860803 O\n0.195059 0.500000 0.214857 O\n0.187985 0.500000 0.579540 O\n0.764081 0.500000 0.777256 O\n0.722388 0.785065 0.139197 O\n",
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{
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"structure_string": "H2 C4 S2 N2 O4\n1.0\n4.616567 0.011067 0.531423\n0.946582 5.993122 2.045002\n-0.092777 -0.053849 6.446713\nH C S N O\n2 4 2 2 4\ndirect\n0.431495 0.188086 0.596748 H\n0.431547 0.688087 0.096738 H\n0.915271 0.242000 0.718390 C\n0.629726 0.248191 0.851811 C\n0.915317 0.742007 0.218376 C\n0.629772 0.748192 0.351802 C\n0.599513 0.276588 0.098853 S\n0.599559 0.776580 0.598846 S\n0.411001 0.234663 0.737259 N\n0.411048 0.734670 0.237244 N\n0.949106 0.249159 0.527200 O\n0.949147 0.749182 0.027185 O\n0.139425 0.728085 0.348713 O\n0.139377 0.228093 0.848722 O\n",
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{
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"structure_string": "Ba1 Sr1 Mg1 Te1 O6\n1.0\n4.955637 -0.000000 2.861139\n1.651879 4.672220 2.861139\n-0.000000 -0.000000 5.722277\nBa Sr Mg Te O\n1 1 1 1 6\ndirect\n0.750001 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Te\n0.741302 0.741302 0.258699 O\n0.258699 0.741302 0.258699 O\n0.741302 0.258698 0.258699 O\n0.258699 0.258698 0.741302 O\n0.741302 0.258698 0.741302 O\n0.258699 0.741302 0.741302 O\n",
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