# generated using pymatgen data_Hf6Al7Cu16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.32515529 _cell_length_b 8.32515477 _cell_length_c 8.32515522 _cell_angle_alpha 59.99999820 _cell_angle_beta 60.00000026 _cell_angle_gamma 60.00000035 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6Al7Cu16 _chemical_formula_sum 'Hf6 Al7 Cu16' _cell_volume 408.00172286 _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 0.70395736 0.29604264 0.29604264 1.0 Hf Hf1 1 0.70395736 0.29604264 0.70395736 1.0 Hf Hf2 1 0.70395736 0.70395736 0.29604264 1.0 Hf Hf3 1 0.29604264 0.70395736 0.70395736 1.0 Hf Hf4 1 0.29604264 0.70395736 0.29604264 1.0 Hf Hf5 1 0.29604264 0.29604264 0.70395736 1.0 Al Al6 1 0.00000000 0.00000000 0.00000000 1.0 Al Al7 1 0.50000000 0.00000000 0.00000000 1.0 Al Al8 1 0.50000000 0.00000000 0.50000000 1.0 Al Al9 1 0.50000000 0.50000000 0.00000000 1.0 Al Al10 1 0.00000000 0.50000000 0.50000000 1.0 Al Al11 1 0.00000000 0.50000000 0.00000000 1.0 Al Al12 1 0.00000000 0.00000000 0.50000000 1.0 Cu Cu13 1 0.64202080 0.11932673 0.11932673 1.0 Cu Cu14 1 0.11932673 0.64202080 0.11932673 1.0 Cu Cu15 1 0.11932673 0.11932673 0.64202080 1.0 Cu Cu16 1 0.11932673 0.11932673 0.11932673 1.0 Cu Cu17 1 0.35797920 0.88067327 0.88067327 1.0 Cu Cu18 1 0.88067327 0.35797920 0.88067327 1.0 Cu Cu19 1 0.88067327 0.88067327 0.35797920 1.0 Cu Cu20 1 0.88067327 0.88067327 0.88067327 1.0 Cu Cu21 1 0.01086346 0.32971251 0.32971251 1.0 Cu Cu22 1 0.32971251 0.01086346 0.32971251 1.0 Cu Cu23 1 0.32971251 0.32971251 0.01086346 1.0 Cu Cu24 1 0.32971251 0.32971251 0.32971251 1.0 Cu Cu25 1 0.98913654 0.67028749 0.67028749 1.0 Cu Cu26 1 0.67028749 0.98913654 0.67028749 1.0 Cu Cu27 1 0.67028749 0.67028749 0.98913654 1.0 Cu Cu28 1 0.67028749 0.67028749 0.67028749 1.0