# generated using pymatgen data_RbCuCl3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.04882833 _cell_length_b 7.04882833 _cell_length_c 12.58885775 _cell_angle_alpha 89.36597372 _cell_angle_beta 89.36597372 _cell_angle_gamma 59.51852065 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbCuCl3 _chemical_formula_sum 'Rb4 Cu4 Cl12' _cell_volume 538.99899952 _cell_formula_units_Z 4 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 0.33675900 0.32210200 0.12508500 1.0 Rb Rb1 1 0.38020300 0.29078200 0.62371200 1.0 Rb Rb2 1 0.67789800 0.66324100 0.87491500 1.0 Rb Rb3 1 0.70921800 0.61979700 0.37628800 1.0 Cu Cu4 1 0.98163800 0.01836200 0.00000000 1.0 Cu Cu5 1 0.02298600 0.97059900 0.25033300 1.0 Cu Cu6 1 0.07651500 0.92348500 0.50000000 1.0 Cu Cu7 1 0.02940100 0.97701400 0.74966700 1.0 Cl Cl8 1 0.66765300 0.16323800 0.90001800 1.0 Cl Cl9 1 0.39215100 0.78109000 0.59945800 1.0 Cl Cl10 1 0.76341000 0.08915200 0.38965900 1.0 Cl Cl11 1 0.28782900 0.84582000 0.11338000 1.0 Cl Cl12 1 0.88099200 0.79884300 0.66219200 1.0 Cl Cl13 1 0.17513400 0.15664600 0.83755700 1.0 Cl Cl14 1 0.83676200 0.33234700 0.09998200 1.0 Cl Cl15 1 0.91084800 0.23659000 0.61034100 1.0 Cl Cl16 1 0.21891000 0.60784900 0.40054200 1.0 Cl Cl17 1 0.20115700 0.11900800 0.33780800 1.0 Cl Cl18 1 0.84335400 0.82486600 0.16244300 1.0 Cl Cl19 1 0.15418000 0.71217100 0.88662000 1.0