# generated using pymatgen data_Ta2Ti(GaIr)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.37825829 _cell_length_b 7.37825757 _cell_length_c 2.91705684 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.86122813 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta2Ti(GaIr)3 _chemical_formula_sum 'Ta2 Ti1 Ga3 Ir3' _cell_volume 137.71739287 _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 0.36855099 0.99958804 0.50000000 1.0 Ta Ta1 1 0.99958804 0.36855099 0.50000000 1.0 Ti Ti2 1 0.62834846 0.62834846 0.50000000 1.0 Ga Ga3 1 0.70623685 0.99698107 0.00000000 1.0 Ga Ga4 1 0.29635459 0.29635459 0.00000000 1.0 Ga Ga5 1 0.99698107 0.70623685 0.00000000 1.0 Ir Ir6 1 0.66609895 0.33578343 0.00000000 1.0 Ir Ir7 1 0.33578243 0.66609795 0.00000000 1.0 Ir Ir8 1 0.00205861 0.00205861 0.50000000 1.0