# generated using pymatgen data_Ba11(Cd4Bi7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.95966638 _cell_length_b 14.69186624 _cell_length_c 17.12397970 _cell_angle_alpha 91.34500118 _cell_angle_beta 90.00293845 _cell_angle_gamma 99.72459989 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba11(Cd4Bi7)2 _chemical_formula_sum 'Ba11 Cd8 Bi14' _cell_volume 1229.49063502 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ba Ba0 1 0.74417687 0.48757913 0.70740657 1.0 Ba Ba1 1 0.38162653 0.76422882 0.83751241 1.0 Ba Ba2 1 0.14520103 0.29061248 0.53716613 1.0 Ba Ba3 1 0.65586258 0.31051413 0.90242375 1.0 Ba Ba4 1 0.99013282 0.98021865 0.63304613 1.0 Ba Ba5 1 0.50000000 0.00000000 -0.00000000 1.0 Ba Ba6 1 0.25582313 0.51242087 0.29259343 1.0 Ba Ba7 1 0.34413742 0.68948587 0.09757625 1.0 Ba Ba8 1 0.85479897 0.70938752 0.46283387 1.0 Ba Ba9 1 0.61837347 0.23577118 0.16248759 1.0 Ba Ba10 1 0.00986718 0.01978135 0.36695387 1.0 Cd Cd11 1 0.79803182 0.59655997 0.95978052 1.0 Cd Cd12 1 0.37830078 0.75656216 0.60819956 1.0 Cd Cd13 1 0.20196818 0.40344003 0.04021948 1.0 Cd Cd14 1 0.59523213 0.18915989 0.68823141 1.0 Cd Cd15 1 0.62169922 0.24343784 0.39180044 1.0 Cd Cd16 1 0.93894754 0.87936173 0.15725574 1.0 Cd Cd17 1 0.06105246 0.12063827 0.84274426 1.0 Cd Cd18 1 0.40476787 0.81084011 0.31176859 1.0 Bi Bi19 1 0.55830087 0.11672258 0.52295500 1.0 Bi Bi20 1 0.90543041 0.81183703 0.98684346 1.0 Bi Bi21 1 0.14899946 0.29676029 0.74114509 1.0 Bi Bi22 1 0.09456959 0.18816297 0.01315654 1.0 Bi Bi23 1 0.85100054 0.70323971 0.25885491 1.0 Bi Bi24 1 0.86524992 0.73073200 0.69222012 1.0 Bi Bi25 1 0.25831413 0.51707981 0.88487665 1.0 Bi Bi26 1 0.44169913 0.88327742 0.47704500 1.0 Bi Bi27 1 0.72744572 0.45488856 0.45692764 1.0 Bi Bi28 1 0.48975372 0.98063822 0.20928130 1.0 Bi Bi29 1 0.27255428 0.54511144 0.54307236 1.0 Bi Bi30 1 0.13475008 0.26926800 0.30777988 1.0 Bi Bi31 1 0.51024628 0.01936178 0.79071870 1.0 Bi Bi32 1 0.74168587 0.48292019 0.11512335 1.0