# generated using pymatgen data_TeMoWS3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.27057832 _cell_length_b 3.27057832 _cell_length_c 37.17529700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000643 _symmetry_Int_Tables_number 1 _chemical_formula_structural TeMoWS3 _chemical_formula_sum 'Te2 Mo2 W2 S6' _cell_volume 344.37701473 _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 0.70944000 1.0 Te Te1 1 0.33333300 0.66666700 0.60571500 1.0 Mo Mo2 1 0.33333300 0.66666700 0.09391000 1.0 Mo Mo3 1 0.66666700 0.33333300 0.65759500 1.0 W W4 1 0.33333300 0.66666700 0.46960600 1.0 W W5 1 0.66666700 0.33333300 0.28180000 1.0 S S6 1 0.33333300 0.66666700 0.32339900 1.0 S S7 1 0.66666700 0.33333300 0.05250800 1.0 S S8 1 0.66666700 0.33333300 0.42804600 1.0 S S9 1 0.66666700 0.33333300 0.13532800 1.0 S S10 1 0.66666700 0.33333300 0.51119100 1.0 S S11 1 0.33333300 0.66666700 0.24020900 1.0