# generated using pymatgen data_Ca5Bi2Pb _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.31695896 _cell_length_b 9.31695882 _cell_length_c 7.10172760 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.98612362 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca5Bi2Pb _chemical_formula_sum 'Ca10 Bi4 Pb2' _cell_volume 533.95383374 _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 Ca Ca0 1 0.66744754 0.32978410 0.50600091 1.0 Ca Ca1 1 0.32978410 0.66744754 0.50600091 1.0 Ca Ca2 1 0.32978410 0.66744754 0.99399909 1.0 Ca Ca3 1 0.66744754 0.32978410 0.99399909 1.0 Ca Ca4 1 0.72153333 0.72153333 0.25000000 1.0 Ca Ca5 1 0.27629652 0.00078813 0.25000000 1.0 Ca Ca6 1 0.00078813 0.27629652 0.25000000 1.0 Ca Ca7 1 0.27246483 0.27246483 0.75000000 1.0 Ca Ca8 1 0.72536803 0.00508328 0.75000000 1.0 Ca Ca9 1 0.00508328 0.72536803 0.75000000 1.0 Bi Bi10 1 0.37759268 0.37759268 0.25000000 1.0 Bi Bi11 1 0.62464275 0.99721588 0.25000000 1.0 Bi Bi12 1 0.99721588 0.62464275 0.25000000 1.0 Bi Bi13 1 0.62818104 0.62818104 0.75000000 1.0 Pb Pb14 1 0.37502238 0.00134786 0.75000000 1.0 Pb Pb15 1 0.00134786 0.37502238 0.75000000 1.0