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"structure_string": "K8 Cu4 Cl12\n1.0\n4.102720 0.000000 0.000000\n0.000000 11.944324 0.000000\n0.000000 0.000000 12.519244\nK Cu Cl\n8 4 12\ndirect\n0.750000 0.674038 0.017634 K\n0.250000 0.487077 0.324961 K\n0.750000 0.174038 0.482366 K\n0.750000 0.512923 0.675039 K\n0.250000 0.825962 0.517634 K\n0.250000 0.987077 0.175039 K\n0.250000 0.325962 0.982366 K\n0.750000 0.012923 0.824960 K\n0.250000 0.245374 0.699305 Cu\n0.750000 0.254626 0.199305 Cu\n0.750000 0.754625 0.300695 Cu\n0.250000 0.745374 0.800695 Cu\n0.250000 0.366620 0.551804 Cl\n0.250000 0.222680 0.291763 Cl\n0.250000 0.722680 0.208236 Cl\n0.750000 0.277320 0.791763 Cl\n0.750000 0.777319 0.708236 Cl\n0.250000 0.558565 0.860585 Cl\n0.750000 0.441434 0.139415 Cl\n0.250000 0.866620 0.948196 Cl\n0.750000 0.633380 0.448196 Cl\n0.750000 0.133380 0.051804 Cl\n0.250000 0.058565 0.639414 Cl\n0.750000 0.941434 0.360585 Cl\n",
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{
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"structure_string": "K8 Ag4 I12\n1.0\n4.746446 -0.000000 0.000000\n-0.000000 9.972472 0.000000\n0.000000 0.000000 19.415636\nK Ag I\n8 4 12\ndirect\n0.750001 0.749019 0.462456 K\n0.250000 0.250981 0.537544 K\n0.750001 0.249019 0.037544 K\n0.250000 0.750981 0.962456 K\n0.750001 0.426578 0.787236 K\n0.250000 0.073422 0.287236 K\n0.750001 0.926578 0.712765 K\n0.250000 0.573422 0.212764 K\n0.750001 0.368026 0.363020 Ag\n0.750001 0.868026 0.136980 Ag\n0.250000 0.631974 0.636980 Ag\n0.250000 0.131974 0.863020 Ag\n0.250000 0.694615 0.780272 I\n0.750001 0.989000 0.901805 I\n0.250000 0.511000 0.401805 I\n0.250000 0.194615 0.719728 I\n0.750001 0.305384 0.219728 I\n0.250000 0.386955 0.928916 I\n0.750001 0.613045 0.071084 I\n0.250000 0.011000 0.098195 I\n0.750001 0.113045 0.428916 I\n0.250000 0.886955 0.571084 I\n0.750001 0.805384 0.280272 I\n0.750001 0.489000 0.598195 I\n",
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"structure_string": "Ag2 Bi4 Se6 Cl2\n1.0\n0.000000 8.122489 0.004152\n4.143068 0.000000 0.000000\n0.000000 -2.769421 -10.871127\nAg Bi Se Cl\n2 4 6 2\ndirect\n0.049963 0.750000 0.412883 Ag\n0.950038 0.250000 0.587118 Ag\n0.807719 0.250000 0.066736 Bi\n0.192281 0.750000 0.933264 Bi\n0.532387 0.750000 0.341186 Bi\n0.467614 0.250000 0.658814 Bi\n0.797631 0.250000 0.335393 Se\n0.954667 0.250000 0.847814 Se\n0.309390 0.250000 0.410752 Se\n0.690611 0.750000 0.589249 Se\n0.202369 0.750000 0.664607 Se\n0.045333 0.750000 0.152186 Se\n0.406092 0.250000 0.098003 Cl\n0.593908 0.750000 0.901997 Cl\n",
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"structure_string": "Pr1 Ni2 P2\n1.0\n3.725496 -0.000000 -1.431828\n-0.550298 3.684629 -1.431828\n0.009986 0.011588 5.588610\nPr Ni P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.750001 0.250000 0.500000 Ni\n0.250001 0.750000 0.500000 Ni\n0.369750 0.369749 0.739497 P\n0.630252 0.630252 0.260502 P\n",
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