# generated using pymatgen data_TeMoWS3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.26977233 _cell_length_b 3.26977233 _cell_length_c 37.13128400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000672 _symmetry_Int_Tables_number 1 _chemical_formula_structural TeMoWS3 _chemical_formula_sum 'Te2 Mo2 W2 S6' _cell_volume 343.79978356 _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 0.33333300 0.66666700 0.41785600 1.0 Te Te1 1 0.33333300 0.66666700 0.52146900 1.0 Mo Mo2 1 0.00000000 0.00000000 0.09392300 1.0 Mo Mo3 1 0.00000000 0.00000000 0.46965500 1.0 W W4 1 0.33333300 0.66666700 0.28175400 1.0 W W5 1 0.33333300 0.66666700 0.65758400 1.0 S S6 1 0.00000000 0.00000000 0.32334700 1.0 S S7 1 0.00000000 0.00000000 0.69915500 1.0 S S8 1 0.33333300 0.66666700 0.05246000 1.0 S S9 1 0.33333300 0.66666700 0.13540300 1.0 S S10 1 0.00000000 0.00000000 0.24017700 1.0 S S11 1 0.00000000 0.00000000 0.61596600 1.0