# generated using pymatgen data_CsGaCuF6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.40979040 _cell_length_b 7.40979040 _cell_length_c 7.40979040 _cell_angle_alpha 121.11358624 _cell_angle_beta 119.86602845 _cell_angle_gamma 89.15714799 _symmetry_Int_Tables_number 1 _chemical_formula_structural CsGaCuF6 _chemical_formula_sum 'Cs2 Ga2 Cu2 F12' _cell_volume 285.46906696 _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 Cs Cs0 1 0.37247900 0.62247900 0.75000000 1.0 Cs Cs1 1 0.62752100 0.37752100 0.25000000 1.0 Ga Ga2 1 0.00000000 0.00000000 0.00000000 1.0 Ga Ga3 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu4 1 0.00000000 0.00000000 0.50000000 1.0 Cu Cu5 1 0.00000000 0.50000000 0.00000000 1.0 F F6 1 0.31295800 0.06295800 0.25000000 1.0 F F7 1 0.93132600 0.68132600 0.25000000 1.0 F F8 1 0.33130100 0.69251700 0.26328000 1.0 F F9 1 0.92923700 0.06802200 0.23672000 1.0 F F10 1 0.33130100 0.06802200 0.63878500 1.0 F F11 1 0.92923700 0.69251700 0.86121500 1.0 F F12 1 0.68704200 0.93704200 0.75000000 1.0 F F13 1 0.06867400 0.31867400 0.75000000 1.0 F F14 1 0.66869900 0.30748300 0.73672000 1.0 F F15 1 0.07076300 0.93197800 0.76328000 1.0 F F16 1 0.66869900 0.93197800 0.36121500 1.0 F F17 1 0.07076300 0.30748300 0.13878500 1.0