# generated using pymatgen data_Ti2Si(Tc2W)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.35570782 _cell_length_b 6.17102277 _cell_length_c 13.08259728 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00069351 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti2Si(Tc2W)3 _chemical_formula_sum 'Ti4 Si2 Tc12 W6' _cell_volume 351.64938384 _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 0.99998115 0.50000100 0.99839399 1.0 Ti Ti1 1 0.49987597 0.00000000 0.16499220 1.0 Ti Ti2 1 0.99987827 0.50000100 0.33501589 1.0 Ti Ti3 1 0.49998655 0.00000000 0.50161110 1.0 Si Si4 1 0.00016313 0.50000100 0.66718622 1.0 Si Si5 1 0.50016405 0.00000000 0.83277215 1.0 Tc Tc6 1 0.49997984 0.24916692 0.99751253 1.0 Tc Tc7 1 0.49997984 0.75083408 0.99751253 1.0 Tc Tc8 1 0.99990073 0.25016167 0.16557484 1.0 Tc Tc9 1 0.99990073 0.74983933 0.16557484 1.0 Tc Tc10 1 0.49989841 0.24983721 0.33443914 1.0 Tc Tc11 1 0.49989841 0.75016279 0.33443914 1.0 Tc Tc12 1 0.99998639 0.25082900 0.50248832 1.0 Tc Tc13 1 0.99998639 0.74917200 0.50248832 1.0 Tc Tc14 1 0.50010299 0.24976587 0.66792751 1.0 Tc Tc15 1 0.50010299 0.75023413 0.66792751 1.0 Tc Tc16 1 0.00009746 0.25023627 0.83206458 1.0 Tc Tc17 1 0.00009746 0.74976473 0.83206458 1.0 W W18 1 0.99997491 0.00000000 0.99617804 1.0 W W19 1 0.49992683 0.50000100 0.16622729 1.0 W W20 1 0.99992930 0.00000000 0.33375937 1.0 W W21 1 0.49997400 0.50000100 0.50382261 1.0 W W22 1 0.00012341 0.00000000 0.66977681 1.0 W W23 1 0.50009877 0.50000100 0.83025149 1.0