# generated using pymatgen data_TiAlNi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.13332408 _cell_length_b 4.13332430 _cell_length_c 4.13332296 _cell_angle_alpha 60.00001070 _cell_angle_beta 60.00000897 _cell_angle_gamma 59.99999833 _symmetry_Int_Tables_number 1 _chemical_formula_structural TiAlNi2 _chemical_formula_sum 'Ti1 Al1 Ni2' _cell_volume 49.93250349 _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 Ti Ti0 1 0.50000000 0.50000000 0.50000000 1.0 Al Al1 1 -0.00000000 0.00000000 0.00000000 1.0 Ni Ni2 1 0.25000000 0.25000000 0.25000000 1.0 Ni Ni3 1 0.75000000 0.75000000 0.75000000 1.0