# generated using pymatgen data_Rb2Cu(BrCl)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.05374861 _cell_length_b 9.05374861 _cell_length_c 7.31605700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 132.35207279 _symmetry_Int_Tables_number 1 _chemical_formula_structural Rb2Cu(BrCl)2 _chemical_formula_sum 'Rb4 Cu2 Br4 Cl4' _cell_volume 443.18966329 _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 Rb Rb0 1 0.86683200 0.13316800 0.50000000 1.0 Rb Rb1 1 0.36683200 0.63316800 0.00000000 1.0 Rb Rb2 1 0.13316800 0.86683200 0.50000000 1.0 Rb Rb3 1 0.63316800 0.36683200 0.00000000 1.0 Cu Cu4 1 0.00000000 0.00000000 0.00000000 1.0 Cu Cu5 1 0.50000000 0.50000000 0.50000000 1.0 Br Br6 1 0.84544200 0.15455800 0.00000000 1.0 Br Br7 1 0.15455800 0.84544200 0.00000000 1.0 Br Br8 1 0.34544200 0.65455800 0.50000000 1.0 Br Br9 1 0.65455800 0.34544200 0.50000000 1.0 Cl Cl10 1 0.78140100 0.78140100 0.21858000 1.0 Cl Cl11 1 0.21859900 0.21859900 0.78142000 1.0 Cl Cl12 1 0.28140100 0.28140100 0.28142000 1.0 Cl Cl13 1 0.71859900 0.71859900 0.71858000 1.0