# generated using pymatgen data_RbCuCl3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.93635163 _cell_length_b 6.93635163 _cell_length_c 6.93635163 _cell_angle_alpha 117.60990333 _cell_angle_beta 117.60990333 _cell_angle_gamma 94.19215198 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbCuCl3 _chemical_formula_sum 'Rb2 Cu2 Cl6' _cell_volume 243.80084804 _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 0.75000000 0.75000000 0.00000000 1.0 Rb Rb1 1 0.25000000 0.25000000 0.00000000 1.0 Cu Cu2 1 0.00000000 0.50000000 0.50000000 1.0 Cu Cu3 1 0.50000000 0.00000000 0.50000000 1.0 Cl Cl4 1 0.28231175 0.78231175 0.06462549 1.0 Cl Cl5 1 0.78231175 0.71768825 0.50000000 1.0 Cl Cl6 1 0.21768825 0.28231175 0.50000000 1.0 Cl Cl7 1 0.71768825 0.21768825 0.93537451 1.0 Cl Cl8 1 0.75000000 0.25000000 0.50000000 1.0 Cl Cl9 1 0.25000000 0.75000000 0.50000000 1.0