# generated using pymatgen data_Hf6Ti5Al11Ir7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.73310697 _cell_length_b 8.73310712 _cell_length_c 8.71810209 _cell_angle_alpha 59.94304638 _cell_angle_beta 59.94304777 _cell_angle_gamma 60.00000354 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6Ti5Al11Ir7 _chemical_formula_sum 'Hf6 Ti5 Al11 Ir7' _cell_volume 469.75361912 _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 0.68856302 0.68856302 0.31309535 1.0 Hf Hf1 1 0.30977961 0.68856302 0.31309535 1.0 Hf Hf2 1 0.68856302 0.30977961 0.31309535 1.0 Hf Hf3 1 0.31454951 0.31454951 0.68765704 1.0 Hf Hf4 1 0.68324194 0.31454951 0.68765704 1.0 Hf Hf5 1 0.31454951 0.68324194 0.68765704 1.0 Ti Ti6 1 0.88046052 0.88046052 0.35861944 1.0 Ti Ti7 1 0.87686132 0.36188501 0.88439236 1.0 Ti Ti8 1 0.36188501 0.87686132 0.88439236 1.0 Ti Ti9 1 0.87686132 0.87686132 0.88439236 1.0 Ti Ti10 1 0.12236965 0.12236965 0.63289104 1.0 Al Al11 1 0.11988064 0.63997104 0.12026667 1.0 Al Al12 1 0.63997104 0.11988064 0.12026667 1.0 Al Al13 1 0.11988064 0.11988064 0.12026667 1.0 Al Al14 1 0.66105418 0.66105418 0.01683647 1.0 Al Al15 1 0.66277102 0.01400653 0.66044943 1.0 Al Al16 1 0.01400653 0.66277102 0.66044943 1.0 Al Al17 1 0.66277102 0.66277102 0.66044943 1.0 Al Al18 1 0.33550643 0.33550643 0.99347970 1.0 Al Al19 1 0.33780507 0.99026227 0.33412858 1.0 Al Al20 1 0.99026227 0.33780507 0.33412858 1.0 Al Al21 1 0.33780507 0.33780507 0.33412858 1.0 Ir Ir22 1 0.00324862 0.00324862 0.99025413 1.0 Ir Ir23 1 0.99898475 0.99898475 0.50480103 1.0 Ir Ir24 1 0.49722947 0.99898475 0.50480103 1.0 Ir Ir25 1 0.99898475 0.49722947 0.50480103 1.0 Ir Ir26 1 0.50179522 0.50179522 0.99784995 1.0 Ir Ir27 1 0.99855961 0.50179522 0.99784995 1.0 Ir Ir28 1 0.50179522 0.99855961 0.99784995 1.0