# generated using pymatgen data_Hf6Zr6Al10Ir7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.00695427 _cell_length_b 8.98428326 _cell_length_c 8.98428363 _cell_angle_alpha 59.79224586 _cell_angle_beta 59.91648825 _cell_angle_gamma 59.91648652 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6Zr6Al10Ir7 _chemical_formula_sum 'Hf6 Zr6 Al10 Ir7' _cell_volume 512.62015735 _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 Hf Hf0 1 0.87621296 0.88533821 0.36223787 1.0 Hf Hf1 1 0.87621296 0.36223787 0.88533821 1.0 Hf Hf2 1 0.36730986 0.88104166 0.88104166 1.0 Hf Hf3 1 0.87060682 0.88104166 0.88104166 1.0 Hf Hf4 1 0.12381325 0.12385756 0.62851595 1.0 Hf Hf5 1 0.12381325 0.62851595 0.12385756 1.0 Zr Zr6 1 0.68251492 0.68906558 0.31566064 1.0 Zr Zr7 1 0.31275886 0.68906558 0.31566064 1.0 Zr Zr8 1 0.68981242 0.31018758 0.31018758 1.0 Zr Zr9 1 0.31275886 0.31566064 0.68906558 1.0 Zr Zr10 1 0.68251492 0.31566064 0.68906558 1.0 Zr Zr11 1 0.31719328 0.68280672 0.68280672 1.0 Al Al12 1 0.63385889 0.12221984 0.12221984 1.0 Al Al13 1 0.12169942 0.12221984 0.12221984 1.0 Al Al14 1 0.65851489 0.65537504 0.02759618 1.0 Al Al15 1 0.65851489 0.02759618 0.65537504 1.0 Al Al16 1 0.02194767 0.65870901 0.65870901 1.0 Al Al17 1 0.66063131 0.65870901 0.65870901 1.0 Al Al18 1 0.34058797 0.33142308 0.98739998 1.0 Al Al19 1 0.34058797 0.98739998 0.33142308 1.0 Al Al20 1 0.97773291 0.33700942 0.33700942 1.0 Al Al21 1 0.34824925 0.33700942 0.33700942 1.0 Ir Ir22 1 0.00333389 0.99666611 0.99666611 1.0 Ir Ir23 1 0.00009330 0.99871592 0.50222227 1.0 Ir Ir24 1 0.49896751 0.99871592 0.50222227 1.0 Ir Ir25 1 0.99964471 0.50035529 0.50035529 1.0 Ir Ir26 1 0.49896751 0.50222227 0.99871592 1.0 Ir Ir27 1 0.00009330 0.50222227 0.99871592 1.0 Ir Ir28 1 0.50104826 0.99895174 0.99895174 1.0