# generated using pymatgen data_CuWSe2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.29201906 _cell_length_b 3.29168000 _cell_length_c 17.85427787 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.96986220 _cell_angle_gamma 60.00340693 _symmetry_Int_Tables_number 1 _chemical_formula_structural CuWSe2 _chemical_formula_sum 'Cu2 W2 Se4' _cell_volume 167.55897650 _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 Cu Cu0 1 0.33291200 0.33354400 0.54093300 1.0 Cu Cu1 1 0.66708800 0.66645600 0.45906700 1.0 W W2 1 0.33358200 0.33320900 0.76672500 1.0 W W3 1 0.66641800 0.66679100 0.23327500 1.0 Se Se4 1 0.33339400 0.33330300 0.13859200 1.0 Se Se5 1 0.66660600 0.66669700 0.86140800 1.0 Se Se6 1 0.66722800 0.66638600 0.67059700 1.0 Se Se7 1 0.33277200 0.33361400 0.32940300 1.0