# generated using pymatgen data_Ta6TeSe2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.61178076 _cell_length_b 7.61178076 _cell_length_c 10.81172797 _cell_angle_alpha 88.89307001 _cell_angle_beta 88.89307001 _cell_angle_gamma 36.76087069 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta6TeSe2 _chemical_formula_sum 'Ta12 Te2 Se4' _cell_volume 374.82178910 _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 0.41308752 0.41308752 0.22148804 1.0 Ta Ta1 1 0.08105208 0.08105208 0.21737196 1.0 Ta Ta2 1 0.74821384 0.74821384 0.21943197 1.0 Ta Ta3 1 0.91894792 0.91894792 0.78262804 1.0 Ta Ta4 1 0.58691248 0.58691248 0.77851196 1.0 Ta Ta5 1 0.25178616 0.25178616 0.78056803 1.0 Ta Ta6 1 0.41753407 0.41753407 0.93164166 1.0 Ta Ta7 1 0.08390906 0.08390906 0.92564286 1.0 Ta Ta8 1 0.75130265 0.75130265 0.92987936 1.0 Ta Ta9 1 0.91609094 0.91609094 0.07435714 1.0 Ta Ta10 1 0.58246593 0.58246593 0.06835834 1.0 Ta Ta11 1 0.24869735 0.24869735 0.07012064 1.0 Te Te12 1 0.08758570 0.08758570 0.63334519 1.0 Te Te13 1 0.91241430 0.91241430 0.36665481 1.0 Se Se14 1 0.75564923 0.75564923 0.66855376 1.0 Se Se15 1 0.41955284 0.41955284 0.67240657 1.0 Se Se16 1 0.58044716 0.58044716 0.32759343 1.0 Se Se17 1 0.24435077 0.24435077 0.33144624 1.0