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{
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{
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"structure_string": "Sr4 Cd4 P8 O28\n1.0\n0.000000 5.480023 0.010213\n8.585377 0.000000 0.000000\n0.000000 -5.465377 -12.969593\nSr Cd P O\n4 4 8 28\ndirect\n0.511590 0.325577 0.228543 Sr\n0.488409 0.825577 0.271457 Sr\n0.488408 0.674423 0.771457 Sr\n0.511590 0.174423 0.728543 Sr\n0.221726 0.358323 0.905204 Cd\n0.778272 0.858323 0.594796 Cd\n0.778272 0.641678 0.094796 Cd\n0.221727 0.141677 0.405204 Cd\n0.927345 0.029867 0.170244 P\n0.072654 0.970133 0.829756 P\n0.927344 0.470133 0.670244 P\n0.072655 0.529867 0.329756 P\n0.173367 0.785420 0.475666 P\n0.173367 0.714580 0.975666 P\n0.826632 0.214580 0.524334 P\n0.826632 0.285420 0.024334 P\n0.717129 0.052236 0.214977 O\n0.815723 0.105067 0.055001 O\n0.184276 0.605067 0.444999 O\n0.184276 0.894934 0.944999 O\n0.815723 0.394934 0.555001 O\n0.011112 0.360541 0.344001 O\n0.011111 0.139459 0.844001 O\n0.988887 0.639459 0.655999 O\n0.189632 0.112829 0.233558 O\n0.810367 0.612830 0.266442 O\n0.282870 0.552236 0.285023 O\n0.988888 0.860542 0.155999 O\n0.282870 0.947764 0.785023 O\n0.885518 0.671617 0.955794 O\n0.635087 0.296962 0.911494 O\n0.364912 0.796963 0.588506 O\n0.364912 0.703038 0.088506 O\n0.635087 0.203038 0.411494 O\n0.114481 0.328383 0.044206 O\n0.885518 0.828383 0.455794 O\n0.810366 0.887171 0.766442 O\n0.114481 0.171617 0.544206 O\n0.722566 0.380797 0.094058 O\n0.277434 0.880797 0.405942 O\n0.277433 0.619204 0.905942 O\n0.722565 0.119203 0.594058 O\n0.717129 0.447764 0.714977 O\n0.189632 0.387171 0.733558 O\n",
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{
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"structure_string": "Sr4 Zr4 Si8 O28\n1.0\n7.253854 0.000000 -2.918414\n0.000000 8.115250 0.000000\n0.011966 0.000000 10.167016\nSr Zr Si O\n4 4 8 28\ndirect\n0.283417 0.482158 0.294687 Sr\n0.716583 0.982158 0.205313 Sr\n0.283417 0.017842 0.794687 Sr\n0.716583 0.517842 0.705314 Sr\n0.256709 0.489202 0.744792 Zr\n0.743292 0.989202 0.755209 Zr\n0.743291 0.510798 0.255209 Zr\n0.256708 0.010798 0.244792 Zr\n0.066212 0.246929 0.458529 Si\n0.933788 0.746929 0.041471 Si\n0.933788 0.753071 0.541472 Si\n0.675196 0.213394 0.461201 Si\n0.324804 0.713394 0.038800 Si\n0.324804 0.786606 0.538800 Si\n0.675196 0.286606 0.961201 Si\n0.066212 0.253071 0.958529 Si\n0.807886 0.731281 0.374172 O\n0.012241 0.078520 0.870797 O\n0.987759 0.578520 0.629204 O\n0.987759 0.921480 0.129204 O\n0.012241 0.421480 0.370797 O\n0.192113 0.231281 0.125828 O\n0.631121 0.093739 0.906589 O\n0.868370 0.345907 0.939342 O\n0.368879 0.593739 0.593412 O\n0.368879 0.906261 0.093412 O\n0.631121 0.406261 0.406589 O\n0.695847 0.293487 0.126816 O\n0.304152 0.793487 0.373185 O\n0.304152 0.706513 0.873185 O\n0.695848 0.206513 0.626816 O\n0.525164 0.409521 0.850463 O\n0.192113 0.268719 0.625829 O\n0.474836 0.909521 0.649538 O\n0.525164 0.090479 0.350463 O\n0.172831 0.366613 0.882129 O\n0.827169 0.866613 0.617872 O\n0.827169 0.633387 0.117872 O\n0.172831 0.133387 0.382128 O\n0.868370 0.154093 0.439342 O\n0.131630 0.654093 0.060658 O\n0.131630 0.845907 0.560658 O\n0.474836 0.590479 0.149538 O\n0.807887 0.768719 0.874172 O\n",
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{
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"structure_string": "P4 S4 N36\n1.0\n6.078145 0.000000 -0.814333\n0.000000 14.889876 0.000000\n-0.070760 0.000000 7.688457\nP S N\n4 4 36\ndirect\n0.082079 0.152038 0.890146 P\n0.917920 0.652038 0.609855 P\n0.917920 0.847962 0.109854 P\n0.082079 0.347962 0.390146 P\n0.281760 0.069023 0.019222 S\n0.718240 0.569023 0.480779 S\n0.718240 0.930978 0.980779 S\n0.281760 0.430978 0.519222 S\n0.333168 0.213289 0.462169 N\n0.470244 0.320158 0.055436 N\n0.529756 0.820158 0.444564 N\n0.529756 0.679842 0.944564 N\n0.470244 0.179842 0.555437 N\n0.840500 0.172910 0.968774 N\n0.159500 0.672910 0.531227 N\n0.187710 0.649952 0.382144 N\n0.840500 0.327090 0.468774 N\n0.812289 0.149952 0.117857 N\n0.666832 0.713289 0.037831 N\n0.187710 0.850048 0.882144 N\n0.812289 0.350048 0.617857 N\n0.768269 0.130462 0.251981 N\n0.231731 0.630462 0.248020 N\n0.159500 0.827090 0.031227 N\n0.666832 0.786711 0.537831 N\n0.814752 0.755269 0.646371 N\n0.185247 0.244731 0.353630 N\n0.983985 0.133648 0.676106 N\n0.016015 0.633648 0.823895 N\n0.016015 0.866352 0.323895 N\n0.983985 0.366352 0.176105 N\n0.874387 0.065629 0.632436 N\n0.125612 0.565629 0.867565 N\n0.125612 0.934371 0.367565 N\n0.874387 0.434371 0.132436 N\n0.773090 0.005203 0.577720 N\n0.226909 0.505203 0.922281 N\n0.226909 0.994797 0.422281 N\n0.773090 0.494797 0.077720 N\n0.185247 0.255269 0.853630 N\n0.231731 0.869539 0.748020 N\n0.814752 0.744731 0.146371 N\n0.333168 0.286711 0.962169 N\n0.768269 0.369538 0.751981 N\n",
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{
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"structure_string": "Li4 U6 P4 O30\n1.0\n6.909783 -0.000000 -1.887565\n-0.515631 6.890516 -1.887565\n0.002613 0.002816 13.600626\nLi U P O\n4 6 4 30\ndirect\n0.691636 0.441637 0.883275 Li\n0.941636 0.191637 0.383275 Li\n0.308363 0.558364 0.116726 Li\n0.058363 0.808364 0.616727 Li\n0.459034 0.209034 0.418068 U\n0.540966 0.790967 0.581933 U\n0.290966 0.040966 0.081933 U\n0.875000 0.625000 0.250001 U\n0.709034 0.959035 0.918068 U\n0.125000 0.375001 0.750000 U\n0.837082 0.087082 0.174164 P\n0.587082 0.337082 0.674164 P\n0.162917 0.912918 0.825837 P\n0.412918 0.662918 0.325837 P\n0.196613 0.446614 0.893227 O\n0.126066 0.703740 0.752135 O\n0.287604 0.293039 0.075209 O\n0.946613 0.696614 0.393227 O\n0.370051 0.951801 0.903602 O\n0.053386 0.303387 0.606774 O\n0.548394 0.626067 0.252134 O\n0.548199 0.466452 0.596400 O\n0.966451 0.048200 0.096400 O\n0.126066 0.048394 0.752134 O\n0.548199 0.129949 0.596400 O\n0.803386 0.553387 0.106774 O\n0.287604 0.782171 0.075209 O\n0.282170 0.787605 0.575210 O\n0.712395 0.217830 0.924792 O\n0.629948 0.048200 0.096400 O\n0.712396 0.706962 0.924792 O\n0.717829 0.212396 0.424792 O\n0.451800 0.533549 0.403601 O\n0.451800 0.870052 0.403601 O\n0.203739 0.626067 0.252134 O\n0.873933 0.296261 0.247867 O\n0.796260 0.373934 0.747867 O\n0.206961 0.212396 0.424791 O\n0.033549 0.951801 0.903601 O\n0.451606 0.373934 0.747867 O\n0.375000 0.125000 0.250000 O\n0.793038 0.787605 0.575210 O\n0.873933 0.951607 0.247867 O\n0.625000 0.875001 0.750001 O\n",
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{
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"structure_string": "H16 C24 S4\n1.0\n8.093619 -0.000000 0.000000\n-0.000000 5.532795 0.000000\n0.000000 0.000000 10.423034\nH C S\n16 24 4\ndirect\n0.157366 0.115279 0.489078 H\n0.348749 0.847016 0.691561 H\n0.651251 0.152983 0.308438 H\n0.848749 0.347016 0.808438 H\n0.651251 0.847016 0.808438 H\n0.348749 0.152983 0.191562 H\n0.848749 0.652983 0.308438 H\n0.151251 0.347016 0.691561 H\n0.151251 0.652983 0.191562 H\n0.657366 0.384721 0.510922 H\n0.157366 0.884720 0.989078 H\n0.842634 0.115279 0.010922 H\n0.657366 0.615279 0.010922 H\n0.342634 0.384721 0.989078 H\n0.842634 0.884720 0.510922 H\n0.342634 0.615279 0.489078 H\n0.587174 0.216921 0.505760 C\n0.412826 0.783078 0.494239 C\n0.083129 0.413256 0.608608 C\n0.916872 0.586743 0.391392 C\n0.416872 0.086744 0.108608 C\n0.083129 0.586743 0.108608 C\n0.916872 0.413256 0.891391 C\n0.583129 0.086744 0.391392 C\n0.416872 0.913256 0.608608 C\n0.087174 0.716920 0.994239 C\n0.583129 0.913256 0.891391 C\n0.912827 0.283079 0.005761 C\n0.003890 0.631889 0.885080 C\n0.412826 0.216921 0.994239 C\n0.912827 0.716920 0.505760 C\n0.087174 0.283079 0.494239 C\n0.496110 0.868109 0.385080 C\n0.503890 0.131890 0.614919 C\n0.996110 0.368110 0.114919 C\n0.503890 0.868109 0.114919 C\n0.496110 0.131890 0.885080 C\n0.996110 0.631889 0.614919 C\n0.003890 0.368110 0.385080 C\n0.587174 0.783078 0.005761 C\n0.500000 0.326515 0.750000 S\n0.000000 0.173484 0.250000 S\n0.000000 0.826515 0.750000 S\n0.500000 0.673484 0.250000 S\n",
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{
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"structure_string": "Mo2 Pd2 H24 N8 O8\n1.0\n-3.732566 3.732770 7.773051\n3.732566 -3.732273 7.772812\n3.732566 3.732273 -7.772812\nMo Pd H N O\n2 2 24 8 8\ndirect\n0.875001 0.124999 0.750002 Mo\n0.124999 0.875002 0.249998 Mo\n0.375000 0.625001 0.750000 Pd\n0.625000 0.374999 0.250000 Pd\n0.014126 0.708348 0.528781 H\n0.679568 0.708347 0.194224 H\n0.708347 0.014119 0.028777 H\n0.485347 0.014122 0.805778 H\n0.679568 0.485345 0.971221 H\n0.708347 0.679569 0.694227 H\n0.485347 0.679569 0.471224 H\n0.985874 0.291653 0.471220 H\n0.320432 0.291653 0.805777 H\n0.291653 0.985881 0.971223 H\n0.014126 0.485346 0.305779 H\n0.985874 0.514655 0.694221 H\n0.514653 0.985878 0.194223 H\n0.309483 0.249644 0.440166 H\n0.249646 0.309480 0.940168 H\n0.869317 0.309478 0.559838 H\n0.309483 0.869317 0.059841 H\n0.750354 0.690521 0.059832 H\n0.690517 0.750357 0.559835 H\n0.130683 0.690522 0.440162 H\n0.690517 0.130683 0.940160 H\n0.514653 0.320431 0.528776 H\n0.291653 0.320432 0.305774 H\n0.320432 0.514656 0.028780 H\n0.651535 0.625605 0.025932 N\n0.099671 0.625604 0.474068 N\n0.625602 0.099669 0.974065 N\n0.625602 0.651536 0.525933 N\n0.348465 0.374396 0.974069 N\n0.900329 0.374397 0.525932 N\n0.374398 0.348464 0.474067 N\n0.374398 0.900331 0.025936 N\n0.255362 0.809496 0.445868 O\n0.190503 0.136368 0.445862 O\n0.136360 0.190503 0.945858 O\n0.744638 0.190505 0.554133 O\n0.190504 0.744642 0.054136 O\n0.809496 0.863632 0.554139 O\n0.863640 0.809498 0.054143 O\n0.809496 0.255359 0.945864 O\n",
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{
"id": "jvasp-97561",
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