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{
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{
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"structure_string": "Cs6 Cr4 Br18\n1.0\n3.894782 -6.745960 0.000000\n3.894782 6.745960 0.000000\n0.000000 0.000000 19.420997\nCs Cr Br\n6 4 18\ndirect\n0.666667 0.333333 0.929823 Cs\n0.333333 0.666667 0.429823 Cs\n0.666667 0.333333 0.570177 Cs\n0.333333 0.666667 0.070177 Cs\n0.000000 0.000000 0.750000 Cs\n0.000000 0.000000 0.250000 Cs\n0.333333 0.666667 0.663369 Cr\n0.666667 0.333333 0.163369 Cr\n0.666667 0.333333 0.336631 Cr\n0.333333 0.666667 0.836631 Cr\n0.820207 0.640413 0.405802 Br\n0.179793 0.359587 0.905802 Br\n0.179793 0.820207 0.905802 Br\n0.179793 0.359587 0.594198 Br\n0.640413 0.820207 0.905802 Br\n0.359587 0.179793 0.405802 Br\n0.038733 0.519366 0.750000 Br\n0.820207 0.179793 0.405802 Br\n0.519366 0.038733 0.250000 Br\n0.480634 0.519366 0.750000 Br\n0.519366 0.480634 0.250000 Br\n0.961267 0.480634 0.250000 Br\n0.359587 0.179793 0.094198 Br\n0.480634 0.961267 0.750000 Br\n0.820207 0.640413 0.094198 Br\n0.179793 0.820207 0.594198 Br\n0.640413 0.820207 0.594198 Br\n0.820207 0.179793 0.094198 Br\n",
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{
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"structure_string": "Cu6 Cl12 O84\n1.0\n22.494983 0.000000 0.000000\n0.000000 4.619526 0.000000\n0.000000 0.178853 14.153892\nCu Cl O\n6 12 84\ndirect\n0.000000 0.500000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n0.333079 0.996677 0.999685 Cu\n0.833079 0.003323 0.500315 Cu\n0.666921 0.003323 0.000315 Cu\n0.166921 0.996677 0.499685 Cu\n0.002957 0.702880 0.341516 Cl\n0.502957 0.297120 0.158484 Cl\n0.997043 0.297120 0.658484 Cl\n0.497043 0.702880 0.841516 Cl\n0.165142 0.243982 0.158397 Cl\n0.665142 0.756018 0.341603 Cl\n0.834858 0.756018 0.841603 Cl\n0.334858 0.243982 0.658397 Cl\n0.329728 0.724395 0.342457 Cl\n0.829728 0.275605 0.157543 Cl\n0.670272 0.275605 0.657543 Cl\n0.170272 0.724395 0.842457 Cl\n0.007448 0.388355 0.329465 O\n0.507448 0.611645 0.170535 O\n0.992552 0.611645 0.670535 O\n0.492552 0.388355 0.829465 O\n0.009700 0.779254 0.439639 O\n0.509700 0.220746 0.060361 O\n0.990300 0.220746 0.560361 O\n0.490300 0.779254 0.939639 O\n0.053093 0.821461 0.285238 O\n0.553093 0.178539 0.214762 O\n0.946907 0.178539 0.714762 O\n0.446907 0.821461 0.785238 O\n0.946810 0.804287 0.304011 O\n0.446810 0.195713 0.195989 O\n0.053190 0.195713 0.695989 O\n0.553190 0.804287 0.804011 O\n0.166008 0.928109 0.160553 O\n0.666008 0.071891 0.339447 O\n0.833992 0.071891 0.839447 O\n0.333992 0.928109 0.660553 O\n0.170330 0.342295 0.060277 O\n0.670330 0.657705 0.439723 O\n0.829670 0.657705 0.939723 O\n0.329670 0.342295 0.560277 O\n0.214159 0.351710 0.214917 O\n0.714159 0.648290 0.285083 O\n0.785841 0.648290 0.785083 O\n0.285841 0.351710 0.714917 O\n0.108291 0.342780 0.197944 O\n0.608291 0.657220 0.302056 O\n0.891709 0.657220 0.802056 O\n0.391709 0.342780 0.697944 O\n0.326219 0.406571 0.347660 O\n0.826219 0.593429 0.152340 O\n0.673781 0.593429 0.652340 O\n0.173781 0.406571 0.847660 O\n0.334409 0.826898 0.439987 O\n0.834409 0.173102 0.060013 O\n0.665591 0.173102 0.560013 O\n0.165591 0.826898 0.939987 O\n0.381451 0.808526 0.288081 O\n0.881451 0.191474 0.211919 O\n0.618549 0.191474 0.711919 O\n0.118549 0.808526 0.788081 O\n0.275069 0.834768 0.299894 O\n0.775069 0.165232 0.200106 O\n0.724931 0.165232 0.700106 O\n0.224931 0.834768 0.799894 O\n0.949774 0.778890 0.046394 O\n0.449774 0.221110 0.453606 O\n0.050226 0.221110 0.953606 O\n0.550226 0.778890 0.546394 O\n0.012395 0.165761 0.104728 O\n0.512395 0.834239 0.395272 O\n0.987605 0.834239 0.895272 O\n0.487605 0.165761 0.604728 O\n0.050197 0.778426 0.048703 O\n0.550197 0.221574 0.451297 O\n0.949803 0.221574 0.951297 O\n0.449803 0.778426 0.548703 O\n0.118245 0.279100 0.448822 O\n0.618245 0.720900 0.051178 O\n0.881755 0.720900 0.551178 O\n0.381755 0.279100 0.948822 O\n0.162158 0.660782 0.395496 O\n0.662158 0.339218 0.104504 O\n0.837842 0.339218 0.604504 O\n0.337842 0.660782 0.895496 O\n0.219028 0.281645 0.459232 O\n0.719028 0.718355 0.040768 O\n0.780972 0.718355 0.540768 O\n0.280972 0.281645 0.959232 O\n0.283394 0.722974 0.051549 O\n0.783394 0.277026 0.448451 O\n0.716606 0.277026 0.948451 O\n0.216606 0.722974 0.551549 O\n0.331955 0.351368 0.101670 O\n0.831955 0.648632 0.398330 O\n0.668045 0.648632 0.898330 O\n0.168045 0.351368 0.601670 O\n0.386463 0.719221 0.041780 O\n0.886463 0.280779 0.458220 O\n0.613537 0.280779 0.958220 O\n0.113537 0.719221 0.541780 O\n",
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{
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{
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