# generated using pymatgen data_Ti3Al3(Ru2Pt)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.25977901 _cell_length_b 6.26493548 _cell_length_c 12.76489291 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00100410 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Al3(Ru2Pt)2 _chemical_formula_sum 'Ti6 Al6 Ru8 Pt4' _cell_volume 340.65976856 _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 Ti Ti0 1 0.00001408 0.49999900 0.99208310 1.0 Ti Ti1 1 0.49995635 0.00000000 0.17466700 1.0 Ti Ti2 1 0.99995467 0.49999900 0.34147330 1.0 Ti Ti3 1 0.49999330 0.00000000 0.50171488 1.0 Ti Ti4 1 0.00004568 0.49999900 0.66496512 1.0 Ti Ti5 1 0.50004926 0.00000000 0.82519074 1.0 Al Al6 1 0.00001998 0.00000000 0.99762374 1.0 Al Al7 1 0.49992972 0.49999900 0.16897205 1.0 Al Al8 1 0.99994378 0.00000000 0.33943451 1.0 Al Al9 1 0.49999970 0.49999900 0.50183714 1.0 Al Al10 1 0.00001157 0.00000000 0.66482207 1.0 Al Al11 1 0.50007430 0.49999900 0.82718119 1.0 Ru Ru12 1 0.49996159 0.24954069 0.32920445 1.0 Ru Ru13 1 0.49996159 0.75046031 0.32920445 1.0 Ru Ru14 1 0.99999833 0.25085279 0.49878971 1.0 Ru Ru15 1 0.99999833 0.74914721 0.49878971 1.0 Ru Ru16 1 0.50003296 0.24913336 0.66785699 1.0 Ru Ru17 1 0.50003296 0.75086764 0.66785699 1.0 Ru Ru18 1 0.00005145 0.25047668 0.83745485 1.0 Ru Ru19 1 0.00005145 0.74952332 0.83745485 1.0 Pt Pt20 1 0.50002905 0.24857133 0.00204892 1.0 Pt Pt21 1 0.50002905 0.75142767 0.00204892 1.0 Pt Pt22 1 0.99992993 0.25129510 0.16466066 1.0 Pt Pt23 1 0.99992993 0.74870490 0.16466066 1.0