# generated using pymatgen data_Ta3Ti2ZnOs6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.41063934 _cell_length_b 6.25183410 _cell_length_c 13.23105643 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00047431 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta3Ti2ZnOs6 _chemical_formula_sum 'Ta6 Ti4 Zn2 Os12' _cell_volume 364.84089583 _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 Ta Ta0 1 0.00001288 0.99999900 0.00554316 1.0 Ta Ta1 1 0.49997155 0.50000000 0.16115761 1.0 Ta Ta2 1 0.99997379 0.99999900 0.32830484 1.0 Ta Ta3 1 0.49999678 0.50000100 0.49976124 1.0 Ta Ta4 1 0.00001016 0.00000000 0.66688186 1.0 Ta Ta5 1 0.50003358 0.50000000 0.83836412 1.0 Ti Ti6 1 0.99998130 0.50000000 0.33233487 1.0 Ti Ti7 1 0.49999437 0.00000000 0.49959888 1.0 Ti Ti8 1 0.00001696 0.49999900 0.66702285 1.0 Ti Ti9 1 0.50002099 0.00000000 0.83434083 1.0 Zn Zn10 1 0.00000613 0.50000000 0.00078756 1.0 Zn Zn11 1 0.49998723 0.00000000 0.16589032 1.0 Os Os12 1 0.50000941 0.24667704 0.99759689 1.0 Os Os13 1 0.50000941 0.75332196 0.99759689 1.0 Os Os14 1 0.99998235 0.25333380 0.16910153 1.0 Os Os15 1 0.99998135 0.74666520 0.16910053 1.0 Os Os16 1 0.49998037 0.25244568 0.33434847 1.0 Os Os17 1 0.49997937 0.74755432 0.33434847 1.0 Os Os18 1 0.99999488 0.24981890 0.49914007 1.0 Os Os19 1 0.99999488 0.75018110 0.49914007 1.0 Os Os20 1 0.50000990 0.25016117 0.66749804 1.0 Os Os21 1 0.50000990 0.74983883 0.66749804 1.0 Os Os22 1 0.00002274 0.24753329 0.83232044 1.0 Os Os23 1 0.00002274 0.75246571 0.83232044 1.0