# generated using pymatgen data_TeW2SeS2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.30645833 _cell_length_b 3.30645833 _cell_length_c 39.07754000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000651 _symmetry_Int_Tables_number 1 _chemical_formula_structural TeW2SeS2 _chemical_formula_sum 'Te2 W4 Se2 S4' _cell_volume 369.98483706 _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 Te Te0 1 0.66666700 0.33333300 0.41965300 1.0 Te Te1 1 0.66666700 0.33333300 0.51808000 1.0 W W2 1 0.33333300 0.66666700 0.09391700 1.0 W W3 1 0.33333300 0.66666700 0.46886400 1.0 W W4 1 0.66666700 0.33333300 0.28112600 1.0 W W5 1 0.66666700 0.33333300 0.65900900 1.0 Se Se6 1 0.33333300 0.66666700 0.70219600 1.0 Se Se7 1 0.33333300 0.66666700 0.61579100 1.0 S S8 1 0.33333300 0.66666700 0.32037300 1.0 S S9 1 0.66666700 0.33333300 0.05469500 1.0 S S10 1 0.66666700 0.33333300 0.13314300 1.0 S S11 1 0.33333300 0.66666700 0.24190200 1.0