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{
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{
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{
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"structure_string": "K8 Sn8 As8 O40\n1.0\n6.820482 0.000000 0.000000\n0.000000 11.144812 0.000000\n0.000000 0.000000 13.704016\nK Sn As O\n8 8 8 40\ndirect\n0.224683 0.298305 0.629982 K\n0.689479 0.561441 0.112114 K\n0.810521 0.561441 0.612114 K\n0.310521 0.061441 0.887886 K\n0.724683 0.798305 0.870018 K\n0.275317 0.298305 0.129982 K\n0.775317 0.798305 0.370018 K\n0.189479 0.061441 0.387886 K\n0.746078 0.250399 0.749823 Sn\n0.253922 0.750399 0.250177 Sn\n0.753922 0.250399 0.249823 Sn\n0.500232 0.998963 0.625987 Sn\n0.499768 0.498963 0.374013 Sn\n0.999768 0.998963 0.125987 Sn\n0.000232 0.498963 0.874013 Sn\n0.246078 0.750399 0.750177 Sn\n0.333925 0.747743 0.502276 As\n0.833925 0.247743 0.997724 As\n0.166075 0.747743 0.002276 As\n0.497712 0.501540 0.822815 As\n0.502288 0.001540 0.177185 As\n0.002288 0.501540 0.322815 As\n0.666075 0.247743 0.497724 As\n0.997712 0.001540 0.677185 As\n0.470130 0.886320 0.259216 O\n0.529870 0.386320 0.740784 O\n0.029870 0.886320 0.759216 O\n0.970130 0.386320 0.240784 O\n0.976690 0.124622 0.753020 O\n0.023310 0.624622 0.246980 O\n0.523310 0.124622 0.253020 O\n0.476690 0.624622 0.746980 O\n0.044708 0.877478 0.232794 O\n0.955292 0.377478 0.767206 O\n0.455292 0.877478 0.732794 O\n0.544708 0.377478 0.267206 O\n0.525207 0.134813 0.723292 O\n0.474793 0.634813 0.276708 O\n0.974793 0.134813 0.223292 O\n0.820863 0.225701 0.400359 O\n0.025207 0.634813 0.776708 O\n0.303258 0.473502 0.898563 O\n0.803258 0.973502 0.601437 O\n0.196742 0.473502 0.398563 O\n0.192045 0.028477 0.599927 O\n0.807955 0.528477 0.400073 O\n0.307955 0.028477 0.099927 O\n0.692045 0.528477 0.900073 O\n0.505143 0.129184 0.510107 O\n0.494857 0.629184 0.489893 O\n0.994857 0.129184 0.010107 O\n0.005143 0.629184 0.989893 O\n0.016808 0.872781 0.010932 O\n0.983192 0.372781 0.989068 O\n0.483192 0.872781 0.510932 O\n0.516808 0.372781 0.489068 O\n0.817169 0.270831 0.596629 O\n0.182831 0.770831 0.403371 O\n0.682831 0.270831 0.096629 O\n0.317169 0.770831 0.903371 O\n0.320863 0.725701 0.099641 O\n0.679137 0.225701 0.900359 O\n0.179137 0.725701 0.599641 O\n0.696742 0.973502 0.101437 O\n",
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{
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"structure_string": "K10 Tb2 H16 C16 O32\n1.0\n-6.000323 -6.008187 0.000000\n-6.000323 6.008187 0.000000\n4.965989 0.000000 -14.775892\nK Tb H C O\n10 2 16 16 32\ndirect\n0.000000 0.000000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.598918 0.202409 0.512160 K\n0.797591 0.401082 0.987840 K\n0.401082 0.797591 0.487840 K\n0.202409 0.598918 0.012160 K\n0.790351 0.596826 0.497638 K\n0.403174 0.209649 0.002362 K\n0.209649 0.403174 0.502362 K\n0.596826 0.790351 0.997638 K\n0.197614 0.802386 0.750000 Tb\n0.802386 0.197614 0.250000 Tb\n0.993502 0.396949 0.714915 H\n0.603051 0.006498 0.785085 H\n0.006498 0.603051 0.285085 H\n0.396949 0.993502 0.214915 H\n0.332301 0.404073 0.774234 H\n0.595927 0.667699 0.725766 H\n0.667699 0.595927 0.225766 H\n0.404073 0.332301 0.274234 H\n0.810882 0.965648 0.739565 H\n0.034352 0.189118 0.760435 H\n0.189118 0.034352 0.260435 H\n0.965648 0.810882 0.239565 H\n0.834002 0.601558 0.769796 H\n0.398442 0.165998 0.730204 H\n0.165998 0.398442 0.230204 H\n0.601558 0.834002 0.269796 H\n0.994896 0.424193 0.648541 C\n0.575807 0.005104 0.851459 C\n0.005104 0.575807 0.351459 C\n0.424193 0.994896 0.148541 C\n0.378264 0.489826 0.840718 C\n0.510174 0.621736 0.659282 C\n0.621736 0.510174 0.159282 C\n0.489826 0.378264 0.340718 C\n0.817943 0.926513 0.667319 C\n0.073487 0.182057 0.832681 C\n0.182057 0.073487 0.332681 C\n0.926513 0.817943 0.167319 C\n0.897231 0.670357 0.838746 C\n0.329643 0.102769 0.661254 C\n0.102769 0.329643 0.161254 C\n0.670357 0.897231 0.338746 C\n0.062883 0.559200 0.650758 O\n0.440800 0.937117 0.849242 O\n0.937117 0.440800 0.349242 O\n0.559200 0.062883 0.150758 O\n0.930256 0.321005 0.576936 O\n0.678995 0.069744 0.923064 O\n0.069744 0.678995 0.423064 O\n0.321005 0.930256 0.076936 O\n0.333447 0.634785 0.847684 O\n0.365215 0.666553 0.652316 O\n0.666553 0.365215 0.152316 O\n0.634785 0.333447 0.347684 O\n0.700785 0.950403 0.607168 O\n0.049597 0.299215 0.892832 O\n0.299215 0.049597 0.392832 O\n0.950403 0.700785 0.107168 O\n0.947724 0.859489 0.653460 O\n0.140511 0.052276 0.846540 O\n0.052276 0.140511 0.346540 O\n0.859489 0.947723 0.153460 O\n0.029687 0.748385 0.844789 O\n0.251615 0.970313 0.655211 O\n0.970313 0.251615 0.155211 O\n0.748385 0.029687 0.344789 O\n0.834961 0.667272 0.904265 O\n0.332728 0.165039 0.595735 O\n0.165039 0.332728 0.095735 O\n0.667272 0.834961 0.404265 O\n0.467903 0.436893 0.902772 O\n0.563107 0.532097 0.597228 O\n0.532097 0.563107 0.097228 O\n0.436893 0.467903 0.402772 O\n",
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{
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"structure_string": "Rb2 Sb4\n1.0\n2.119316 7.098748 0.000000\n-2.119316 7.098748 0.000000\n0.000000 2.131307 8.459979\nRb Sb\n2 4\ndirect\n0.164709 0.164709 0.302227 Rb\n0.835291 0.835291 0.697773 Rb\n0.434711 0.434711 0.313643 Sb\n0.095233 0.095233 0.892495 Sb\n0.904767 0.904767 0.107505 Sb\n0.565289 0.565289 0.686357 Sb\n",
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{
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{
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"structure_string": "Pr2 C12 N18\n1.0\n3.947469 -5.948164 0.000000\n3.947469 5.948164 0.000000\n0.000000 0.000000 10.570139\nPr C N\n2 12 18\ndirect\n0.714197 0.285803 0.750000 Pr\n0.285803 0.714197 0.250000 Pr\n0.710866 0.001885 0.448597 C\n0.001885 0.710866 0.551403 C\n0.289134 0.998115 0.551403 C\n0.444212 0.270623 0.250000 C\n0.998115 0.289134 0.051403 C\n0.555788 0.729377 0.750000 C\n0.729377 0.555788 0.250000 C\n0.270623 0.444212 0.750000 C\n0.289134 0.998115 0.948597 C\n0.998115 0.289134 0.448597 C\n0.710866 0.001885 0.051403 C\n0.001885 0.710866 0.948597 C\n0.156803 0.843197 0.007922 N\n0.843197 0.156803 0.992078 N\n0.583015 0.859703 0.402054 N\n0.642600 0.907287 0.750000 N\n0.092713 0.357400 0.750000 N\n0.416985 0.140297 0.597946 N\n0.468584 0.531416 0.750000 N\n0.531416 0.468584 0.250000 N\n0.140297 0.416985 0.402054 N\n0.859703 0.583015 0.597946 N\n0.357400 0.092713 0.250000 N\n0.140297 0.416985 0.097946 N\n0.416985 0.140297 0.902054 N\n0.907287 0.642600 0.250000 N\n0.583015 0.859703 0.097946 N\n0.843197 0.156803 0.507922 N\n0.859703 0.583015 0.902054 N\n0.156803 0.843197 0.492078 N\n",
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{
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"structure_string": "Se8 N4 Cl12\n1.0\n9.779531 0.000000 0.000000\n0.000000 7.882046 0.000000\n0.000000 0.568442 9.577036\nSe N Cl\n8 4 12\ndirect\n0.529783 0.392196 0.285218 Se\n0.029783 0.107804 0.714782 Se\n0.115100 0.550683 0.316952 Se\n0.615100 0.949317 0.683048 Se\n0.384900 0.050683 0.316952 Se\n0.470217 0.607804 0.714782 Se\n0.884900 0.449317 0.683048 Se\n0.970217 0.892196 0.285218 Se\n0.499078 0.189217 0.223810 N\n0.500922 0.810783 0.776190 N\n0.999078 0.310783 0.776190 N\n0.000922 0.689217 0.223810 N\n0.853224 0.205176 0.508463 Cl\n0.595703 0.156897 0.832341 Cl\n0.325512 0.524912 0.883192 Cl\n0.095703 0.343103 0.167659 Cl\n0.404297 0.843103 0.167659 Cl\n0.174488 0.024912 0.883192 Cl\n0.904297 0.656897 0.832341 Cl\n0.646776 0.705176 0.508463 Cl\n0.825512 0.975088 0.116808 Cl\n0.674488 0.475088 0.116808 Cl\n0.146776 0.794824 0.491537 Cl\n0.353224 0.294824 0.491537 Cl\n",
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}