# generated using pymatgen data_Y6Al7Cu16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.66952435 _cell_length_b 8.66952902 _cell_length_c 8.66948324 _cell_angle_alpha 119.99982533 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00053858 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y6Al7Cu16 _chemical_formula_sum 'Y6 Al7 Cu16' _cell_volume 460.75133251 _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 Y Y0 1 0.28626483 1.00000000 0.28626483 1.0 Y Y1 1 0.71373517 0.00000000 0.28626483 1.0 Y Y2 1 0.28626383 0.57252865 0.28626483 1.0 Y Y3 1 0.28626483 1.00000000 0.71373517 1.0 Y Y4 1 0.71373517 0.00000000 0.71373517 1.0 Y Y5 1 0.71373617 0.42747235 0.71373517 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 0.00000000 0.50000000 0.00000000 1.0 Al Al9 1 0.50000000 0.50000000 0.00000000 1.0 Al Al10 1 0.00000000 0.00000000 0.50000000 1.0 Al Al11 1 0.00000000 0.50000000 0.50000000 1.0 Al Al12 1 0.50000000 0.50000000 0.50000000 1.0 Cu Cu13 1 0.67417207 0.34834314 0.02251321 1.0 Cu Cu14 1 0.36755969 0.24503846 0.12251823 1.0 Cu Cu15 1 0.87747977 0.24503846 0.12251823 1.0 Cu Cu16 1 0.87748277 0.75496454 0.12251823 1.0 Cu Cu17 1 0.67417207 0.34834314 0.32583093 1.0 Cu Cu18 1 0.67417307 0.65165886 0.32582893 1.0 Cu Cu19 1 0.97748879 0.65165786 0.32582893 1.0 Cu Cu20 1 0.12251723 0.24503646 0.36755569 1.0 Cu Cu21 1 0.87748277 0.75496454 0.63244431 1.0 Cu Cu22 1 0.02251221 0.34834214 0.67417107 1.0 Cu Cu23 1 0.32582693 0.34834114 0.67417107 1.0 Cu Cu24 1 0.32582793 0.65165686 0.67416907 1.0 Cu Cu25 1 0.12251723 0.24503646 0.87748177 1.0 Cu Cu26 1 0.12252023 0.75496254 0.87748177 1.0 Cu Cu27 1 0.63244031 0.75496254 0.87748177 1.0 Cu Cu28 1 0.32582793 0.65165686 0.97748779 1.0