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0.182630 0.299895 Hg\n0.799895 0.054728 0.817370 Hg\n0.200105 0.554728 0.682630 Hg\n0.317370 0.700105 0.945272 Hg\n0.945272 0.317370 0.700105 Hg\n0.500000 0.000000 0.000000 Bi\n0.000000 0.000000 0.500000 Bi\n0.000000 0.500000 0.000000 Bi\n0.500000 0.500000 0.500000 Bi\n0.740161 0.759839 0.240161 Sb\n0.259839 0.259839 0.259839 Sb\n0.759839 0.259839 0.240161 Sb\n0.133969 0.133969 0.133969 Sb\n0.866032 0.866032 0.866032 Sb\n0.759839 0.240161 0.740161 Sb\n0.240161 0.740161 0.759839 Sb\n0.366032 0.633969 0.133969 Sb\n0.633969 0.133969 0.366032 Sb\n0.366032 0.866032 0.633969 Sb\n0.633969 0.366032 0.866032 Sb\n0.133969 0.366032 0.633969 Sb\n0.740161 0.740161 0.740161 Sb\n0.240161 0.759839 0.259839 Sb\n0.866032 0.633969 0.366032 Sb\n0.259839 0.240161 0.759839 Sb\n0.044555 0.055739 0.707534 Br\n0.292467 0.544555 0.444261 Br\n0.207534 0.044555 0.444261 Br\n0.207534 0.455445 0.944262 Br\n0.944262 0.292467 0.955445 Br\n0.955445 0.555739 0.792467 Br\n0.044555 0.444261 0.207534 Br\n0.555739 0.707534 0.455445 Br\n0.055739 0.792467 0.544555 Br\n0.792467 0.955445 0.555739 Br\n0.555739 0.792467 0.955445 Br\n0.792467 0.544555 0.055739 Br\n0.000000 0.500000 0.500000 Br\n0.055739 0.707534 0.044555 Br\n0.500000 0.000000 0.500000 Br\n0.944262 0.207534 0.455445 Br\n0.955445 0.944262 0.292467 Br\n0.292467 0.955445 0.944262 Br\n0.707534 0.044555 0.055739 Br\n0.455445 0.944262 0.207534 Br\n0.000000 0.000000 0.000000 Br\n0.544555 0.444261 0.292467 Br\n0.444261 0.207534 0.044555 Br\n0.544555 0.055739 0.792467 Br\n0.455445 0.555739 0.707534 Br\n0.707534 0.455445 0.555739 Br\n0.444261 0.292467 0.544555 Br\n0.500000 0.500000 0.000000 Br\n","nsites":72,"nelements":4,"elements":["Hg","Bi","Sb","Br"],"chemical_system":"Bi-Br-Hg-Sb","density":6.993819178326699,"density_atomic":0.030831807739451156,"volume":2335.2506803508527,"volume_molar":19.532233759664724,"formula_full":"Hg24 Bi4 Sb16 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Zr\n0.692903 0.738310 0.564694 Zr\n0.872305 0.735245 0.064839 Zr\n0.127695 0.264756 0.935161 Zr\n0.807097 0.238310 0.435306 Zr\n0.408146 0.777127 0.340115 Si\n0.066921 0.219544 0.159471 Si\n0.933079 0.780456 0.840529 Si\n0.091855 0.277127 0.659885 Si\n0.591855 0.222873 0.659885 Si\n0.908146 0.722873 0.340114 Si\n0.566921 0.280456 0.159471 Si\n0.433079 0.719544 0.840529 Si\n0.149912 0.251486 0.292399 O\n0.889112 0.430586 0.356959 O\n0.658320 0.399645 0.616751 O\n0.734557 0.035308 0.507768 O\n0.370139 0.801478 0.910210 O\n0.158320 0.100355 0.616751 O\n0.140183 0.219779 0.791428 O\n0.870139 0.698522 0.910210 O\n0.765443 0.535308 0.492232 O\n0.841680 0.899645 0.383249 O\n0.234557 0.464692 0.507768 O\n0.389112 0.069414 0.356959 O\n0.859817 0.780221 0.208572 O\n0.610888 0.930586 0.643041 O\n0.270517 0.473938 0.001469 O\n0.359817 0.719779 0.208572 O\n0.958009 0.213054 0.589730 O\n0.969272 0.072057 0.864336 O\n0.265443 0.964692 0.492232 O\n0.541991 0.713054 0.410269 O\n0.469272 0.427943 0.864336 O\n0.350088 0.751486 0.707601 O\n0.850088 0.748514 0.707601 O\n0.110888 0.569414 0.643041 O\n0.030728 0.927943 0.135664 O\n0.958573 0.396886 0.122941 O\n0.629861 0.198522 0.089790 O\n0.041991 0.786946 0.410270 O\n0.458009 0.286946 0.589730 O\n0.341680 0.600355 0.383249 O\n0.541427 0.896886 0.877059 O\n0.041427 0.603114 0.877059 O\n0.229483 0.973938 0.998531 O\n0.649912 0.248514 0.292399 O\n0.129861 0.301478 0.089790 O\n0.530728 0.572057 0.135664 O\n0.770517 0.026062 0.001469 O\n0.458574 0.103114 0.122941 O\n0.729483 0.526062 0.998531 O\n0.640183 0.280221 0.791428 O\n","nsites":72,"nelements":4,"elements":["Na","Zr","Si","O"],"chemical_system":"Na-O-Si-Zr","density":3.5431684448767853,"density_atomic":0.07829109769015001,"volume":919.6447887977242,"volume_molar":7.691986621306064,"formula_full":"Na16 Zr8 Si8 O40","formula_reduced":"Na2ZrSiO5","formula_anonymous":"ABC2D5","energy_above_hull":2.0530531777777776,"spacegroup":14}]}