# generated using pymatgen data_Zr6Ti7Al9Ir8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.88899272 _cell_length_b 8.88899213 _cell_length_c 8.88899210 _cell_angle_alpha 59.74676533 _cell_angle_beta 59.74676882 _cell_angle_gamma 59.74677497 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6Ti7Al9Ir8 _chemical_formula_sum 'Zr6 Ti7 Al9 Ir8' _cell_volume 493.78512419 _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 Zr Zr0 1 0.20903108 0.20903108 0.78987816 1.0 Zr Zr1 1 0.78987816 0.20903108 0.20903108 1.0 Zr Zr2 1 0.20903108 0.78987816 0.20903108 1.0 Zr Zr3 1 0.79466568 0.79466568 0.19696622 1.0 Zr Zr4 1 0.19696622 0.79466568 0.79466568 1.0 Zr Zr5 1 0.79466568 0.19696622 0.79466568 1.0 Ti Ti6 1 0.37825611 0.37825611 0.37825611 1.0 Ti Ti7 1 0.37890273 0.86479002 0.37890273 1.0 Ti Ti8 1 0.86479002 0.37890273 0.37890273 1.0 Ti Ti9 1 0.37890273 0.37890273 0.86479002 1.0 Ti Ti10 1 0.83503294 0.49913563 0.83503294 1.0 Ti Ti11 1 0.49913563 0.83503294 0.83503294 1.0 Ti Ti12 1 0.83503294 0.83503294 0.49913563 1.0 Al Al13 1 0.16322880 0.16322880 0.16322880 1.0 Al Al14 1 0.16622354 0.50351753 0.16622354 1.0 Al Al15 1 0.50351753 0.16622354 0.16622354 1.0 Al Al16 1 0.16622354 0.16622354 0.50351753 1.0 Al Al17 1 0.61982658 0.61982658 0.61982658 1.0 Al Al18 1 0.61919694 0.14362657 0.61919694 1.0 Al Al19 1 0.14362657 0.61919694 0.61919694 1.0 Al Al20 1 0.61919694 0.61919694 0.14362657 1.0 Al Al21 1 0.82777581 0.82777581 0.82777581 1.0 Ir Ir22 1 0.00345670 0.00345670 0.49796827 1.0 Ir Ir23 1 0.49796827 0.00345670 0.00345670 1.0 Ir Ir24 1 0.00345670 0.49796827 0.00345670 1.0 Ir Ir25 1 0.49856777 0.49856777 0.00229672 1.0 Ir Ir26 1 0.00229672 0.49856777 0.49856777 1.0 Ir Ir27 1 0.49856777 0.00229672 0.49856777 1.0 Ir Ir28 1 0.50085281 0.50085281 0.50085281 1.0 Ir Ir29 1 0.00172503 0.00172503 0.00172503 1.0