# generated using pymatgen data_Nb10Al4Ni _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.87135548 _cell_length_b 9.87135548 _cell_length_c 5.18647852 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb10Al4Ni _chemical_formula_sum 'Nb20 Al8 Ni2' _cell_volume 505.38944418 _cell_formula_units_Z 2 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 0.40047945 0.40047945 0.00000000 1.0 Nb Nb1 1 0.90047945 0.09952055 0.50000000 1.0 Nb Nb2 1 0.09952055 0.90047945 0.50000000 1.0 Nb Nb3 1 0.59952055 0.59952055 0.00000000 1.0 Nb Nb4 1 0.12913992 0.46538673 0.00000000 1.0 Nb Nb5 1 0.96538673 0.37086008 0.50000000 1.0 Nb Nb6 1 0.03461327 0.62913992 0.50000000 1.0 Nb Nb7 1 0.87086008 0.53461327 0.00000000 1.0 Nb Nb8 1 0.37086008 0.96538673 0.50000000 1.0 Nb Nb9 1 0.62913992 0.03461327 0.50000000 1.0 Nb Nb10 1 0.46538673 0.12913992 0.00000000 1.0 Nb Nb11 1 0.53461327 0.87086008 0.00000000 1.0 Nb Nb12 1 0.18152219 0.18152219 0.25197099 1.0 Nb Nb13 1 0.68152219 0.31847781 0.75197099 1.0 Nb Nb14 1 0.31847781 0.68152219 0.75197099 1.0 Nb Nb15 1 0.81847781 0.81847781 0.25197099 1.0 Nb Nb16 1 0.31847781 0.68152219 0.24802901 1.0 Nb Nb17 1 0.68152219 0.31847781 0.24802901 1.0 Nb Nb18 1 0.18152219 0.18152219 0.74802901 1.0 Nb Nb19 1 0.81847781 0.81847781 0.74802901 1.0 Al Al20 1 0.25242583 0.93569426 0.00000000 1.0 Al Al21 1 0.43569426 0.24757417 0.50000000 1.0 Al Al22 1 0.56430574 0.75242583 0.50000000 1.0 Al Al23 1 0.74757417 0.06430574 0.00000000 1.0 Al Al24 1 0.24757417 0.43569426 0.50000000 1.0 Al Al25 1 0.75242583 0.56430574 0.50000000 1.0 Al Al26 1 0.93569426 0.25242583 0.00000000 1.0 Al Al27 1 0.06430574 0.74757417 0.00000000 1.0 Ni Ni28 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni29 1 0.50000000 0.50000000 0.50000000 1.0