# generated using pymatgen data_TaAl2Ni9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.57571161 _cell_length_b 3.57571161 _cell_length_c 10.57171699 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaAl2Ni9 _chemical_formula_sum 'Ta1 Al2 Ni9' _cell_volume 135.16694483 _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 Ta Ta0 1 0.00000000 0.00000000 0.00000000 1.0 Al Al1 1 0.00000000 -0.00000000 0.33922084 1.0 Al Al2 1 0.00000000 0.00000000 0.66077916 1.0 Ni Ni3 1 0.50000000 0.50000000 0.00000000 1.0 Ni Ni4 1 0.50000000 0.50000000 0.33664121 1.0 Ni Ni5 1 0.50000000 0.50000000 0.66335879 1.0 Ni Ni6 1 0.50000000 0.00000000 0.17179938 1.0 Ni Ni7 1 0.50000000 0.00000000 0.50000000 1.0 Ni Ni8 1 0.50000000 -0.00000000 0.82820062 1.0 Ni Ni9 1 0.00000000 0.50000000 0.17179938 1.0 Ni Ni10 1 0.00000000 0.50000000 0.50000000 1.0 Ni Ni11 1 -0.00000000 0.50000000 0.82820062 1.0