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{
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{
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"structure_string": "Na2 Al2 B2 P4 H6 O20\n1.0\n4.001468 5.214294 -0.002673\n-4.001468 5.214294 -0.002673\n0.000000 4.126659 8.072413\nNa Al B P H O\n2 2 2 4 6 20\ndirect\n0.135133 0.864866 0.250000 Na\n0.864866 0.135134 0.750000 Na\n-0.000000 0.500000 0.000000 Al\n0.500000 -0.000000 0.500000 Al\n0.530917 0.469082 0.250000 B\n0.469082 0.530917 0.750000 B\n0.289867 0.156529 0.819333 P\n0.843470 0.710132 0.680667 P\n0.156529 0.289867 0.319334 P\n0.710132 0.843470 0.180667 P\n-0.000000 0.500000 0.500000 H\n0.314005 0.676276 0.565538 H\n0.676276 0.314004 0.065538 H\n0.685995 0.323723 0.434462 H\n0.323723 0.685995 0.934462 H\n0.500000 -0.000000 0.000000 H\n0.635303 0.042467 0.043492 O\n0.957532 0.364696 0.456508 O\n0.364696 0.957532 0.956508 O\n0.042467 0.635303 0.543492 O\n0.933291 0.715287 0.108885 O\n0.284712 0.066708 0.391116 O\n0.066708 0.284712 0.891115 O\n0.715287 0.933291 0.608885 O\n0.078805 0.274495 0.184841 O\n0.274495 0.078805 0.684841 O\n0.921195 0.725504 0.815160 O\n0.528204 0.689193 0.256572 O\n0.310806 0.471795 0.243428 O\n0.689193 0.528204 0.756572 O\n0.432700 0.700661 0.597640 O\n0.299339 0.567299 0.902360 O\n0.567299 0.299338 0.402360 O\n0.700661 0.432700 0.097641 O\n0.725504 0.921194 0.315160 O\n0.471795 0.310806 0.743428 O\n",
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{
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"structure_string": "H16 C18 S2\n1.0\n6.078836 -0.042039 -0.579036\n-2.736264 5.654690 -1.238065\n-0.106849 0.005944 10.426756\nH C S\n16 18 2\ndirect\n0.737703 0.372612 0.036876 H\n0.372671 0.250403 0.364494 H\n0.372671 0.250402 0.864494 H\n0.456242 0.665874 0.594143 H\n0.083727 0.543018 0.421700 H\n0.083726 0.543018 0.921700 H\n0.977224 0.291444 0.690941 H\n0.977224 0.291444 0.190941 H\n0.456242 0.665874 0.094144 H\n0.892306 0.808429 0.082382 H\n0.170798 0.051356 0.169541 H\n0.170799 0.051357 0.669542 H\n0.785886 0.120074 0.785306 H\n0.785886 0.120074 0.285306 H\n0.737702 0.372613 0.536876 H\n0.892306 0.808428 0.582382 H\n0.845433 0.109542 0.188742 C\n0.970139 0.823240 0.287551 C\n0.970139 0.823240 0.787552 C\n0.388821 0.119590 0.413410 C\n0.388821 0.119589 0.913409 C\n0.595645 0.189317 0.512093 C\n0.595646 0.189318 0.012093 C\n0.845432 0.109542 0.688741 C\n0.198544 0.887072 0.380514 C\n0.979535 0.947877 0.677161 C\n0.623233 0.029285 0.579512 C\n0.623233 0.029285 0.079512 C\n0.228572 0.725134 0.447226 C\n0.228571 0.725133 0.947226 C\n0.436662 0.794249 0.543698 C\n0.436662 0.794249 0.043698 C\n0.979535 0.947877 0.177161 C\n0.198545 0.887073 0.880514 C\n0.705969 0.625909 0.806386 S\n0.705969 0.625908 0.306386 S\n",
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{
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"structure_string": "Zn4 Pb8 F24\n1.0\n5.708149 -0.000000 -0.000000\n-0.000000 5.708149 -0.000000\n-0.000000 0.000000 16.022523\nZn Pb F\n4 8 24\ndirect\n0.500000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.000000 0.500000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.008814 0.008814 0.844136 Pb\n0.991186 0.991186 0.155864 Pb\n0.508814 0.508814 0.155864 Pb\n0.008814 0.491186 0.344136 Pb\n0.491186 0.008814 0.344136 Pb\n0.991186 0.508814 0.655864 Pb\n0.491186 0.491186 0.844136 Pb\n0.508814 0.991186 0.655864 Pb\n0.556847 0.556847 0.622008 F\n0.750000 0.250000 0.500000 F\n0.250000 0.750000 0.000000 F\n0.250000 0.750000 0.500000 F\n0.750000 0.250000 0.000000 F\n0.943153 0.943153 0.622008 F\n0.750000 0.750000 0.759707 F\n0.556847 0.943153 0.122008 F\n0.750000 0.750000 0.259707 F\n0.250000 0.250000 0.740293 F\n0.250000 0.250000 0.240293 F\n0.750000 0.250000 0.250000 F\n0.250000 0.750000 0.750000 F\n0.250000 0.750000 0.250000 F\n0.943153 0.556847 0.122008 F\n0.750000 0.250000 0.750000 F\n0.750000 0.750000 0.462138 F\n0.250000 0.250000 0.537862 F\n0.250000 0.250000 0.037862 F\n0.056847 0.056847 0.377992 F\n0.443153 0.056847 0.877992 F\n0.056847 0.443153 0.877992 F\n0.750000 0.750000 0.962138 F\n0.443153 0.443153 0.377992 F\n",
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{
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"created_at": "2022-09-04T14:38:27.288615Z",
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"structure_string": "Rb12 Zn4 Br20\n1.0\n9.003553 -0.000000 0.000000\n-0.000000 10.486662 0.000000\n0.000000 0.000000 13.252502\nRb Zn Br\n12 4 20\ndirect\n0.416001 0.250000 0.547918 Rb\n0.916000 0.250000 0.952082 Rb\n0.583999 0.750000 0.452082 Rb\n0.083999 0.750000 0.047918 Rb\n0.414940 0.017130 0.828111 Rb\n0.914940 0.482870 0.671888 Rb\n0.585060 0.517130 0.171888 Rb\n0.085060 0.982869 0.328111 Rb\n0.585060 0.982869 0.171888 Rb\n0.085060 0.517130 0.328111 Rb\n0.414940 0.482870 0.828111 Rb\n0.914940 0.017130 0.671888 Rb\n0.189731 0.750000 0.607407 Zn\n0.689731 0.750000 0.892592 Zn\n0.310268 0.250000 0.107408 Zn\n0.810268 0.250000 0.392592 Zn\n0.831740 0.750000 0.234508 Br\n0.313475 0.553968 0.562803 Br\n0.813475 0.946032 0.937197 Br\n0.313475 0.946032 0.562803 Br\n0.813475 0.553968 0.937197 Br\n0.686525 0.446032 0.437197 Br\n0.186525 0.053968 0.062803 Br\n0.331740 0.750000 0.265492 Br\n0.668259 0.250000 0.734508 Br\n0.866195 0.250000 0.213826 Br\n0.460728 0.750000 0.990743 Br\n0.960728 0.750000 0.509256 Br\n0.539272 0.250000 0.009257 Br\n0.039272 0.250000 0.490743 Br\n0.133805 0.750000 0.786174 Br\n0.633804 0.750000 0.713826 Br\n0.186525 0.446032 0.062803 Br\n0.366195 0.250000 0.286174 Br\n0.168260 0.250000 0.765492 Br\n0.686525 0.053968 0.437197 Br\n",
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