# generated using pymatgen data_YbLuB6Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.59145976 _cell_length_b 9.05509771 _cell_length_c 11.42786776 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YbLuB6Ir _chemical_formula_sum 'Yb4 Lu4 B24 Ir4' _cell_volume 371.64590522 _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 Yb Yb0 1 0.00000000 0.32253121 0.41416041 1.0 Yb Yb1 1 0.00000000 0.67746879 0.58583959 1.0 Yb Yb2 1 0.00000000 0.82253121 0.08583959 1.0 Yb Yb3 1 0.00000000 0.17746879 0.91416041 1.0 Lu Lu4 1 0.00000000 0.94475728 0.37455073 1.0 Lu Lu5 1 0.00000000 0.05524272 0.62544927 1.0 Lu Lu6 1 0.00000000 0.44475728 0.12544927 1.0 Lu Lu7 1 0.00000000 0.55524272 0.87455073 1.0 B B8 1 0.50000000 0.55461373 0.43279407 1.0 B B9 1 0.50000000 0.44538627 0.56720593 1.0 B B10 1 0.50000000 0.05461373 0.06720593 1.0 B B11 1 0.50000000 0.94538627 0.93279407 1.0 B B12 1 0.50000000 0.74965816 0.42018291 1.0 B B13 1 0.50000000 0.25034184 0.57981709 1.0 B B14 1 0.50000000 0.24965816 0.07981709 1.0 B B15 1 0.50000000 0.75034184 0.92018291 1.0 B B16 1 0.50000000 0.79137666 0.26546709 1.0 B B17 1 0.50000000 0.20862334 0.73453291 1.0 B B18 1 0.50000000 0.29137666 0.23453291 1.0 B B19 1 0.50000000 0.70862334 0.76546709 1.0 B B20 1 0.50000000 0.63170410 0.18304906 1.0 B B21 1 0.50000000 0.36829590 0.81695094 1.0 B B22 1 0.50000000 0.13170410 0.31695094 1.0 B B23 1 0.50000000 0.86829590 0.68304906 1.0 B B24 1 0.50000000 0.98352505 0.21333078 1.0 B B25 1 0.50000000 0.01647495 0.78666922 1.0 B B26 1 0.50000000 0.48352505 0.28666922 1.0 B B27 1 0.50000000 0.51647495 0.71333078 1.0 B B28 1 0.50000000 0.60565891 0.02870143 1.0 B B29 1 0.50000000 0.39434109 0.97129857 1.0 B B30 1 0.50000000 0.10565891 0.47129857 1.0 B B31 1 0.50000000 0.89434109 0.52870143 1.0 Ir Ir32 1 0.00000000 0.63888056 0.31984312 1.0 Ir Ir33 1 0.00000000 0.36111944 0.68015688 1.0 Ir Ir34 1 0.00000000 0.13888056 0.18015688 1.0 Ir Ir35 1 0.00000000 0.86111944 0.81984312 1.0