# generated using pymatgen data_Ce2(Al3Ir)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.58590449 _cell_length_b 7.58590449 _cell_length_c 9.39189108 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.59341633 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce2(Al3Ir)3 _chemical_formula_sum 'Ce4 Al18 Ir6' _cell_volume 469.96248093 _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 Ce Ce0 1 0.99618957 0.67061954 0.25000000 1.0 Ce Ce1 1 0.00381043 0.32938046 0.75000000 1.0 Ce Ce2 1 0.67061954 0.99618957 0.25000000 1.0 Ce Ce3 1 0.32938046 0.00381043 0.75000000 1.0 Al Al4 1 0.13019921 0.13019921 0.25000000 1.0 Al Al5 1 0.86980079 0.86980079 0.75000000 1.0 Al Al6 1 0.00336194 0.33531563 0.07452421 1.0 Al Al7 1 0.99663806 0.66468437 0.92547579 1.0 Al Al8 1 0.99663806 0.66468437 0.57452421 1.0 Al Al9 1 0.33531563 0.00336194 0.42547579 1.0 Al Al10 1 0.00336194 0.33531563 0.42547579 1.0 Al Al11 1 0.66468437 0.99663806 0.57452421 1.0 Al Al12 1 0.66468437 0.99663806 0.92547579 1.0 Al Al13 1 0.33531563 0.00336194 0.07452421 1.0 Al Al14 1 0.33486534 0.33486534 0.54901932 1.0 Al Al15 1 0.66513466 0.66513466 0.45098068 1.0 Al Al16 1 0.66513466 0.66513466 0.04901932 1.0 Al Al17 1 0.33486534 0.33486534 0.95098068 1.0 Al Al18 1 0.34205805 0.54805231 0.25000000 1.0 Al Al19 1 0.65794195 0.45194769 0.75000000 1.0 Al Al20 1 0.54805231 0.34205805 0.25000000 1.0 Al Al21 1 0.45194769 0.65794195 0.75000000 1.0 Ir Ir22 1 0.67236354 0.32763646 -0.00000000 1.0 Ir Ir23 1 0.32763646 0.67236354 -0.00000000 1.0 Ir Ir24 1 0.32763646 0.67236354 0.50000000 1.0 Ir Ir25 1 0.67236354 0.32763646 0.50000000 1.0 Ir Ir26 1 0.00000000 0.00000000 -0.00000000 1.0 Ir Ir27 1 0.00000000 0.00000000 0.50000000 1.0