# generated using pymatgen data_CePr4Ir3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.30023096 _cell_length_b 11.30023096 _cell_length_c 6.49096410 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CePr4Ir3 _chemical_formula_sum 'Ce4 Pr16 Ir12' _cell_volume 828.86508837 _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 Ce Ce0 1 0.00000000 0.00000000 0.50000000 1.0 Ce Ce1 1 0.00000000 0.00000000 0.00000000 1.0 Ce Ce2 1 0.50000000 0.50000000 0.00000000 1.0 Ce Ce3 1 0.50000000 0.50000000 0.50000000 1.0 Pr Pr4 1 0.29106093 0.08941040 0.37690629 1.0 Pr Pr5 1 0.29106093 0.91058960 0.87690629 1.0 Pr Pr6 1 0.70893907 0.08941040 0.87690629 1.0 Pr Pr7 1 0.70893907 0.91058960 0.37690629 1.0 Pr Pr8 1 0.58941040 0.79106093 0.87690629 1.0 Pr Pr9 1 0.58941040 0.20893907 0.37690629 1.0 Pr Pr10 1 0.41058960 0.79106093 0.37690629 1.0 Pr Pr11 1 0.41058960 0.20893907 0.87690629 1.0 Pr Pr12 1 0.20893907 0.41058960 0.62309371 1.0 Pr Pr13 1 0.20893907 0.58941040 0.12309371 1.0 Pr Pr14 1 0.79106093 0.41058960 0.12309371 1.0 Pr Pr15 1 0.79106093 0.58941040 0.62309371 1.0 Pr Pr16 1 0.91058960 0.70893907 0.12309371 1.0 Pr Pr17 1 0.91058960 0.29106093 0.62309371 1.0 Pr Pr18 1 0.08941040 0.70893907 0.62309371 1.0 Pr Pr19 1 0.08941040 0.29106093 0.12309371 1.0 Ir Ir20 1 0.85304352 0.14695648 0.25000000 1.0 Ir Ir21 1 0.85304352 0.85304352 0.75000000 1.0 Ir Ir22 1 0.14695648 0.14695648 0.75000000 1.0 Ir Ir23 1 0.14695648 0.85304352 0.25000000 1.0 Ir Ir24 1 0.64695648 0.35304352 0.75000000 1.0 Ir Ir25 1 0.64695648 0.64695648 0.25000000 1.0 Ir Ir26 1 0.35304352 0.35304352 0.25000000 1.0 Ir Ir27 1 0.35304352 0.64695648 0.75000000 1.0 Ir Ir28 1 0.50000000 0.00000000 0.10981403 1.0 Ir Ir29 1 0.50000000 0.00000000 0.60981403 1.0 Ir Ir30 1 0.00000000 0.50000000 0.89018597 1.0 Ir Ir31 1 0.00000000 0.50000000 0.39018597 1.0