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"structure_string": "Cd1 H14 C9 O4\n1.0\n4.022758 0.104233 0.428257\n1.073276 4.187673 0.294830\n0.058064 -0.055964 13.365775\nCd H C O\n1 14 9 4\ndirect\n0.502744 0.972637 0.831660 Cd\n0.472249 0.936414 0.436277 H\n0.886899 0.129446 0.177975 H\n0.509300 0.141526 0.121314 H\n0.709757 0.774129 0.277757 H\n0.790246 0.409144 0.348285 H\n0.100783 0.926614 0.380521 H\n0.509527 0.386330 0.515662 H\n0.942956 0.621402 0.084856 H\n0.509255 0.715144 0.053192 H\n0.204286 0.656971 0.212390 H\n0.285215 0.290686 0.282142 H\n0.124452 0.978343 0.587253 H\n0.796543 0.787137 0.591647 H\n0.109941 0.401500 0.472504 H\n0.863690 0.335540 0.970647 C\n0.738735 0.518171 0.066670 C\n0.647231 0.292365 0.152819 C\n0.411809 0.462866 0.242338 C\n0.264636 0.552227 0.495077 C\n0.344141 0.772919 0.406886 C\n0.079483 0.739004 0.588447 C\n0.188900 0.582028 0.689277 C\n0.583048 0.602504 0.317797 C\n0.134039 0.098785 0.971659 O\n0.080197 0.754333 0.767995 O\n0.390308 0.300475 0.691644 O\n0.686958 0.414828 0.894135 O\n",
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{
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"structure_string": "Ce1 Zn1 Ag1 P2\n1.0\n4.179698 0.000000 0.000000\n-2.089848 3.619725 0.000000\n0.000000 0.000000 6.763432\nCe Zn Ag P\n1 1 1 2\ndirect\n0.333334 0.666668 0.008829 Ce\n0.666667 0.333334 0.627589 Zn\n0.000000 0.000000 0.364155 Ag\n0.000000 0.000000 0.752884 P\n0.666667 0.333334 0.246543 P\n",
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{
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"created_at": "2022-09-04T14:36:53.805261Z",
"updated_at": "2022-09-04T14:36:53.805281Z",
"structure_string": "Ca1 Fe2 Bi1 O6\n1.0\n4.685808 0.024855 -2.692175\n-1.557923 4.419309 -2.692175\n-0.017494 -0.024855 5.404100\nCa Fe Bi O\n1 2 1 6\ndirect\n0.985756 0.985756 0.000003 Ca\n0.252984 0.752983 0.500001 Fe\n0.752984 0.252983 0.500001 Fe\n0.461822 0.461822 0.000001 Bi\n0.510346 0.023467 0.000001 O\n0.023467 0.510346 0.000001 O\n0.023467 0.023466 0.513121 O\n0.510347 0.510346 0.486880 O\n0.007867 0.507866 0.500001 O\n0.507867 0.007867 0.500001 O\n",
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{
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"updated_at": "2022-09-04T14:36:55.115587Z",
"structure_string": "Li2 Co3 Ni1 O8\n1.0\n2.801688 -4.889726 0.006434\n2.833784 4.908256 -0.000000\n2.829263 1.638696 4.733257\nLi Co Ni O\n2 3 1 8\ndirect\n0.500000 0.000000 0.500000 Li\n0.499999 0.500000 0.500000 Li\n-0.000001 0.500000 0.000000 Co\n0.500000 0.000000 -0.000000 Co\n0.500000 0.500000 -0.000000 Co\n0.000000 0.000000 0.000000 Ni\n0.269317 0.032717 0.203883 O\n0.268203 0.532594 0.203016 O\n0.759450 0.024960 0.209859 O\n0.759449 0.524629 0.209859 O\n0.240550 0.475370 0.790140 O\n0.240549 0.975039 0.790140 O\n0.731796 0.467406 0.796983 O\n0.730682 0.967283 0.796117 O\n",
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{
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"created_at": "2022-09-04T14:36:53.533514Z",
"updated_at": "2022-09-04T14:36:53.533525Z",
"structure_string": "H4 C6 S2 O1\n1.0\n4.521639 0.026144 -0.953430\n-1.544618 4.798238 -1.383614\n0.056134 -0.008288 6.794891\nH C S O\n4 6 2 1\ndirect\n0.985860 0.608107 0.852786 H\n0.332393 0.061570 0.216026 H\n0.293457 0.404020 0.566582 H\n0.295034 0.493063 0.971198 H\n0.182431 0.003339 0.311949 C\n0.159771 0.184668 0.499095 C\n0.952472 0.058759 0.595022 C\n0.991767 0.734611 0.267612 C\n0.042639 0.457556 0.929240 C\n0.873885 0.159668 0.785615 C\n0.779530 0.705612 0.448776 S\n0.605903 0.953607 0.854104 S\n0.939475 0.491420 0.118448 O\n",
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{
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"created_at": "2022-09-04T14:36:53.463098Z",
"updated_at": "2022-09-04T14:36:53.463117Z",
"structure_string": "Sr2 Ge2 H4 O8\n1.0\n5.944047 0.023903 -1.827725\n-3.237827 4.984851 -1.827725\n-0.012915 -0.023903 6.218690\nSr Ge H O\n2 2 4 8\ndirect\n0.500000 0.500000 0.000001 Sr\n0.249999 0.750000 0.500001 Sr\n0.000000 0.000000 0.000000 Ge\n0.750000 0.250000 0.500001 Ge\n0.697944 0.625000 0.572945 H\n0.374999 0.947944 0.072945 H\n0.874999 0.302055 0.927056 H\n0.052055 0.125000 0.427056 H\n0.015843 0.929227 0.260567 O\n0.070773 0.331339 0.086617 O\n0.244722 0.984157 0.913384 O\n0.668660 0.755277 0.739434 O\n0.081339 0.320773 0.586617 O\n0.734156 0.494723 0.413384 O\n0.679226 0.265843 0.760567 O\n0.505276 0.918660 0.239434 O\n",
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"structure_string": "Zr1 Sc1 Mn1 Ni3\n1.0\n4.283119 -0.000000 -2.479719\n-1.423741 4.039563 2.479719\n-0.023775 0.016829 4.897824\nZr Sc Mn Ni\n1 1 1 3\ndirect\n0.997323 0.002676 0.991971 Zr\n0.251248 0.748751 0.753745 Sc\n0.625198 0.374801 0.875595 Mn\n0.625020 0.374979 0.376228 Ni\n0.625020 0.873812 0.376228 Ni\n0.126187 0.374979 0.376228 Ni\n",
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{
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"created_at": "2022-09-04T14:36:53.377649Z",
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"structure_string": "Al1 In1 Ag2 S4\n1.0\n5.262837 -0.006490 -4.365164\n-1.165526 5.132158 -4.365164\n0.005188 0.006490 6.837549\nAl In Ag S\n1 1 2 4\ndirect\n0.250000 0.750000 0.500001 Al\n0.000000 0.000000 0.000000 In\n0.750000 0.250000 0.500001 Ag\n0.500000 0.500000 0.000001 Ag\n0.134433 0.091270 0.491550 S\n0.599721 0.642883 0.508451 S\n0.357117 0.865568 0.956839 S\n0.908730 0.400280 0.043163 S\n",
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"structure_string": "Sn1 H18 C10 O4\n1.0\n4.547978 0.042242 0.090996\n1.422530 6.638557 2.311628\n-0.212367 -0.254103 9.434039\nSn H C O\n1 18 10 4\ndirect\n0.275397 0.305223 0.334398 Sn\n0.504514 0.640392 0.884861 H\n0.235874 0.958072 0.296732 H\n-0.012047 0.685090 0.318260 H\n0.865340 0.611584 0.164036 H\n0.220123 0.682690 0.163707 H\n0.383337 0.831869 0.716658 H\n0.507464 0.915569 0.448897 H\n0.973583 0.508550 0.780593 H\n0.107522 0.963939 0.476040 H\n0.419083 0.598232 0.560932 H\n0.502765 0.395961 0.720334 H\n0.920685 0.019816 0.063566 H\n0.823921 0.225190 0.905345 H\n0.360916 0.104113 0.849065 H\n0.454501 0.902011 0.012919 H\n0.955700 0.784137 0.908606 H\n0.831595 0.976337 0.740852 H\n0.890218 0.709578 0.615652 H\n0.751811 0.876223 0.838430 C\n0.553263 0.001780 0.922848 C\n0.726585 0.119502 0.990791 C\n0.609759 0.496916 0.635986 C\n0.785674 0.612287 0.704613 C\n0.531836 0.234240 0.081020 C\n0.797485 0.375842 0.548424 C\n0.281194 0.994226 0.398252 C\n0.058409 0.611721 0.233381 C\n0.586333 0.739681 0.787622 C\n0.082845 0.345257 0.560143 O\n0.660674 0.250866 0.199271 O\n0.253138 0.301046 0.050523 O\n0.674428 0.307846 0.456596 O\n",
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"structure_string": "Tl1 Bi1 Te1 Se1\n1.0\n4.517239 0.000000 0.000000\n0.000000 4.517239 0.000000\n0.000000 0.000000 6.214855\nTl Bi Te Se\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Bi\n0.000000 0.000000 0.500000 Te\n0.500000 0.500000 -0.000000 Se\n",
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}