# generated using pymatgen data_Ca5Ga2Pb _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.38464631 _cell_length_b 9.38464597 _cell_length_c 9.38464571 _cell_angle_alpha 129.05145690 _cell_angle_beta 129.05145997 _cell_angle_gamma 74.92778834 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca5Ga2Pb _chemical_formula_sum 'Ca10 Ga4 Pb2' _cell_volume 485.44571161 _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 0.50000000 0.50000000 0.00000000 1.0 Ca Ca1 1 0.00000000 0.00000000 0.00000000 1.0 Ca Ca2 1 0.54346083 0.04346083 0.86004248 1.0 Ca Ca3 1 0.18341835 0.68341835 0.13995752 1.0 Ca Ca4 1 0.04346083 0.18341835 0.50000000 1.0 Ca Ca5 1 0.68341835 0.54346083 0.50000000 1.0 Ca Ca6 1 0.45653917 0.95653917 0.13995752 1.0 Ca Ca7 1 0.81658165 0.31658165 0.86004248 1.0 Ca Ca8 1 0.95653917 0.81658165 0.50000000 1.0 Ca Ca9 1 0.31658165 0.45653917 0.50000000 1.0 Ga Ga10 1 0.89008144 0.39008144 0.28016489 1.0 Ga Ga11 1 0.10991856 0.60991856 0.71983511 1.0 Ga Ga12 1 0.39008144 0.10991856 0.50000000 1.0 Ga Ga13 1 0.60991856 0.89008144 0.50000000 1.0 Pb Pb14 1 0.25000000 0.25000000 0.00000000 1.0 Pb Pb15 1 0.75000000 0.75000000 0.00000000 1.0