# generated using pymatgen data_Nb4AlGa5Ni2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.09181662 _cell_length_b 5.08290684 _cell_length_c 7.83153259 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.05800216 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb4AlGa5Ni2 _chemical_formula_sum 'Nb4 Al1 Ga5 Ni2' _cell_volume 175.43173863 _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 0.66644696 0.33289293 0.06885804 1.0 Nb Nb1 1 0.66644696 0.33289293 0.43114296 1.0 Nb Nb2 1 0.33274120 0.66548040 0.56959884 1.0 Nb Nb3 1 0.33274120 0.66548040 0.93040216 1.0 Al Al4 1 0.83379379 0.66758857 0.75000000 1.0 Ga Ga5 1 0.16826242 0.33652285 0.24999900 1.0 Ga Ga6 1 0.16835937 0.83142340 0.24999900 1.0 Ga Ga7 1 0.66306504 0.83142340 0.24999900 1.0 Ga Ga8 1 0.33833201 0.17029221 0.75000000 1.0 Ga Ga9 1 0.83196120 0.17029221 0.75000000 1.0 Ni Ni10 1 0.99892592 0.99785285 0.99971392 1.0 Ni Ni11 1 0.99892592 0.99785285 0.50028608 1.0