# generated using pymatgen data_Ba3BiPb4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.55450671 _cell_length_b 9.55450747 _cell_length_c 9.55450709 _cell_angle_alpha 120.27118853 _cell_angle_beta 120.27119335 _cell_angle_gamma 89.53092555 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba3BiPb4 _chemical_formula_sum 'Ba6 Bi2 Pb8' _cell_volume 614.20057983 _cell_formula_units_Z 2 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 0.25000000 0.25000000 0.00000000 1.0 Ba Ba1 1 0.75000000 0.75000000 0.00000000 1.0 Ba Ba2 1 0.16539208 0.66539208 0.83078515 1.0 Ba Ba3 1 0.83460792 0.33460792 0.16921485 1.0 Ba Ba4 1 0.66539208 0.83460792 0.50000000 1.0 Ba Ba5 1 0.33460792 0.16539208 0.50000000 1.0 Bi Bi6 1 0.00000000 0.00000000 0.00000000 1.0 Bi Bi7 1 0.50000000 0.50000000 0.00000000 1.0 Pb Pb8 1 0.83310865 0.33310865 0.78305809 1.0 Pb Pb9 1 0.16689135 0.66689135 0.21694191 1.0 Pb Pb10 1 0.55005156 0.05005156 0.21694191 1.0 Pb Pb11 1 0.33310865 0.55005156 0.50000000 1.0 Pb Pb12 1 0.94994844 0.16689135 0.50000000 1.0 Pb Pb13 1 0.44994844 0.94994844 0.78305809 1.0 Pb Pb14 1 0.66689135 0.44994844 0.50000000 1.0 Pb Pb15 1 0.05005156 0.83310865 0.50000000 1.0