# generated using pymatgen data_Ti7Nb5ZnSn9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.30421542 _cell_length_b 9.30839939 _cell_length_c 5.63840952 _cell_angle_alpha 90.00000428 _cell_angle_beta 89.92175547 _cell_angle_gamma 120.01487999 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti7Nb5ZnSn9 _chemical_formula_sum 'Ti7 Nb5 Zn1 Sn9' _cell_volume 422.84026436 _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 0.68857193 0.84370278 0.23753513 1.0 Ti Ti1 1 0.31142807 0.15512984 0.76246487 1.0 Ti Ti2 1 0.84380395 0.15662002 0.76277074 1.0 Ti Ti3 1 0.15619605 0.31281706 0.23722926 1.0 Ti Ti4 1 0.49933986 0.99992978 0.49928485 1.0 Ti Ti5 1 0.00000000 0.50107376 0.50000000 1.0 Ti Ti6 1 0.50066014 0.50058891 0.50071515 1.0 Nb Nb7 1 0.84633730 0.69144012 0.75788283 1.0 Nb Nb8 1 0.15366270 0.84510383 0.24211717 1.0 Nb Nb9 1 0.49957444 0.50004550 0.99805154 1.0 Nb Nb10 1 1.00000000 0.49891955 0.00000000 1.0 Nb Nb11 1 0.50042556 0.00047206 0.00194846 1.0 Zn Zn12 1 0.00000000 0.00181486 0.50000000 1.0 Sn Sn13 1 0.20000207 0.39953771 0.73470383 1.0 Sn Sn14 1 0.79999793 0.19953563 0.26529617 1.0 Sn Sn15 1 0.40256906 0.20245743 0.26440168 1.0 Sn Sn16 1 0.59743094 0.79988837 0.73559832 1.0 Sn Sn17 1 0.20399699 0.79791347 0.73864696 1.0 Sn Sn18 1 0.79600301 0.59391647 0.26135304 1.0 Sn Sn19 1 0.66523174 0.33027911 0.75853419 1.0 Sn Sn20 1 0.33476826 0.66504836 0.24146581 1.0 Sn Sn21 1 1.00000000 0.00376539 0.00000000 1.0