# generated using pymatgen data_Cu3S2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.47250806 _cell_length_b 5.93388300 _cell_length_c 3.47250806 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu3S2 _chemical_formula_sum 'Cu3 S2' _cell_volume 71.55261411 _cell_formula_units_Z 1 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 0.50000000 0.75000000 0.00000000 1.0 Cu Cu1 1 0.00000000 0.42003000 0.00000000 1.0 Cu Cu2 1 0.50000000 0.07997000 0.50000000 1.0 S S3 1 0.00000000 0.01841900 0.00000000 1.0 S S4 1 0.50000000 0.48158100 0.50000000 1.0