# generated using pymatgen data_Cu3Se2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.31788968 _cell_length_b 6.32503858 _cell_length_c 6.32503962 _cell_angle_alpha 90.00009439 _cell_angle_beta 89.99996803 _cell_angle_gamma 90.00002268 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu3Se2 _chemical_formula_sum 'Cu6 Se4' _cell_volume 172.74201103 _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 0.99999900 0.00000200 -0.00000000 1.0 Cu Cu1 1 0.99999900 0.49999800 0.50000100 1.0 Cu Cu2 1 0.75998663 0.14389298 0.35625852 1.0 Cu Cu3 1 0.24001437 0.35625552 0.85610502 1.0 Cu Cu4 1 0.24001437 0.64374248 0.14389298 1.0 Cu Cu5 1 0.75998663 0.85610902 0.64374248 1.0 Se Se6 1 0.26461303 0.26888580 0.23104217 1.0 Se Se7 1 0.73538697 0.23104317 0.73111520 1.0 Se Se8 1 0.73538797 0.76895683 0.26888480 1.0 Se Se9 1 0.26461303 0.73111420 0.76895783 1.0