# generated using pymatgen data_Nb4Al6NiAu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.17143231 _cell_length_b 5.17143375 _cell_length_c 7.99169875 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99997835 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb4Al6NiAu _chemical_formula_sum 'Nb4 Al6 Ni1 Au1' _cell_volume 185.09370153 _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 0.33333300 0.66666700 0.42912551 1.0 Nb Nb1 1 0.66666700 0.33333300 0.57087449 1.0 Nb Nb2 1 0.66666700 0.33333300 0.92770283 1.0 Nb Nb3 1 0.33333300 0.66666700 0.07229717 1.0 Al Al4 1 0.83038485 0.16961515 0.23759178 1.0 Al Al5 1 0.83038485 0.66076970 0.23759178 1.0 Al Al6 1 0.33923030 0.16961515 0.23759178 1.0 Al Al7 1 0.16961515 0.83038485 0.76240822 1.0 Al Al8 1 0.16961515 0.33923030 0.76240822 1.0 Al Al9 1 0.66076970 0.83038485 0.76240822 1.0 Ni Ni10 1 0.00000000 0.00000000 0.00000000 1.0 Au Au11 1 0.00000000 0.00000000 0.50000000 1.0