# generated using pymatgen data_Nb20Al8CuNi _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.88620308 _cell_length_b 9.88620308 _cell_length_c 5.18928491 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.05225222 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb20Al8CuNi _chemical_formula_sum 'Nb20 Al8 Cu1 Ni1' _cell_volume 507.18498752 _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 Nb Nb0 1 0.39917907 0.39917907 0.00000000 1.0 Nb Nb1 1 0.90010323 0.09989677 0.50000000 1.0 Nb Nb2 1 0.09989677 0.90010323 0.50000000 1.0 Nb Nb3 1 0.60082093 0.60082093 0.00000000 1.0 Nb Nb4 1 0.12909335 0.46619142 0.00000000 1.0 Nb Nb5 1 0.96551387 0.37064706 0.50000000 1.0 Nb Nb6 1 0.03448613 0.62935294 0.50000000 1.0 Nb Nb7 1 0.87090665 0.53380858 0.00000000 1.0 Nb Nb8 1 0.37064706 0.96551387 0.50000000 1.0 Nb Nb9 1 0.62935294 0.03448613 0.50000000 1.0 Nb Nb10 1 0.46619142 0.12909335 0.00000000 1.0 Nb Nb11 1 0.53380858 0.87090665 0.00000000 1.0 Nb Nb12 1 0.18130882 0.18130882 0.25250022 1.0 Nb Nb13 1 0.68278000 0.31722000 0.75323855 1.0 Nb Nb14 1 0.31722000 0.68278000 0.75323855 1.0 Nb Nb15 1 0.81869118 0.81869118 0.25250022 1.0 Nb Nb16 1 0.31722000 0.68278000 0.24676145 1.0 Nb Nb17 1 0.68278000 0.31722000 0.24676145 1.0 Nb Nb18 1 0.18130882 0.18130882 0.74749978 1.0 Nb Nb19 1 0.81869118 0.81869118 0.74749978 1.0 Al Al20 1 0.25203520 0.93623508 0.00000000 1.0 Al Al21 1 0.43512571 0.24533973 0.50000000 1.0 Al Al22 1 0.56487429 0.75466027 0.50000000 1.0 Al Al23 1 0.74796480 0.06376492 0.00000000 1.0 Al Al24 1 0.24533973 0.43512571 0.50000000 1.0 Al Al25 1 0.75466027 0.56487429 0.50000000 1.0 Al Al26 1 0.93623508 0.25203520 0.00000000 1.0 Al Al27 1 0.06376492 0.74796480 0.00000000 1.0 Cu Cu28 1 0.50000000 0.50000000 0.50000000 1.0 Ni Ni29 1 0.00000000 0.00000000 0.00000000 1.0