# generated using pymatgen data_CsTlF3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.78968856 _cell_length_b 4.78968856 _cell_length_c 4.78968825 _cell_angle_alpha 90.00414871 _cell_angle_beta 90.00414871 _cell_angle_gamma 90.00414620 _symmetry_Int_Tables_number 1 _chemical_formula_structural CsTlF3 _chemical_formula_sum 'Cs1 Tl1 F3' _cell_volume 109.88079514 _cell_formula_units_Z 1 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 0.04722830 0.04722830 0.04722830 1.0 Tl Tl1 1 0.54688796 0.54688796 0.54688796 1.0 F F2 1 0.04687885 0.54650495 0.54650495 1.0 F F3 1 0.54650495 0.54650495 0.04687885 1.0 F F4 1 0.54650495 0.04687885 0.54650495 1.0