# generated using pymatgen data_Nb20Al9Ni _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.92495278 _cell_length_b 9.92495278 _cell_length_c 5.19207723 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.64995281 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb20Al9Ni _chemical_formula_sum 'Nb20 Al9 Ni1' _cell_volume 511.43440053 _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 0.39639921 0.39639921 0.00000000 1.0 Nb Nb1 1 0.90004384 0.09995616 0.50000000 1.0 Nb Nb2 1 0.09995616 0.90004384 0.50000000 1.0 Nb Nb3 1 0.60360079 0.60360079 0.00000000 1.0 Nb Nb4 1 0.12731395 0.46507487 0.00000000 1.0 Nb Nb5 1 0.96501947 0.36977312 0.50000000 1.0 Nb Nb6 1 0.03498053 0.63022688 0.50000000 1.0 Nb Nb7 1 0.87268605 0.53492513 0.00000000 1.0 Nb Nb8 1 0.36977312 0.96501947 0.50000000 1.0 Nb Nb9 1 0.63022688 0.03498053 0.50000000 1.0 Nb Nb10 1 0.46507487 0.12731395 0.00000000 1.0 Nb Nb11 1 0.53492513 0.87268605 0.00000000 1.0 Nb Nb12 1 0.17999726 0.17999726 0.25204683 1.0 Nb Nb13 1 0.68279763 0.31720237 0.75285424 1.0 Nb Nb14 1 0.31720237 0.68279763 0.75285424 1.0 Nb Nb15 1 0.82000274 0.82000274 0.25204683 1.0 Nb Nb16 1 0.31720237 0.68279763 0.24714576 1.0 Nb Nb17 1 0.68279763 0.31720237 0.24714576 1.0 Nb Nb18 1 0.17999726 0.17999726 0.74795317 1.0 Nb Nb19 1 0.82000274 0.82000274 0.74795317 1.0 Al Al20 1 0.50000000 0.50000000 0.50000000 1.0 Al Al21 1 0.25225076 0.93545390 0.00000000 1.0 Al Al22 1 0.43291280 0.23869323 0.50000000 1.0 Al Al23 1 0.56708720 0.76130677 0.50000000 1.0 Al Al24 1 0.74774924 0.06454610 0.00000000 1.0 Al Al25 1 0.23869323 0.43291280 0.50000000 1.0 Al Al26 1 0.76130677 0.56708720 0.50000000 1.0 Al Al27 1 0.93545390 0.25225076 0.00000000 1.0 Al Al28 1 0.06454610 0.74774924 0.00000000 1.0 Ni Ni29 1 0.00000000 0.00000000 0.00000000 1.0