# generated using pymatgen data_Cu3Ge _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.54115926 _cell_length_b 4.17076720 _cell_length_c 5.21102834 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu3Ge _chemical_formula_sum 'Cu6 Ge2' _cell_volume 98.69749214 _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 0.16331172 0.75000000 0.25000000 1.0 Cu Cu1 1 0.83668828 0.25000000 0.75000000 1.0 Cu Cu2 1 0.33709903 0.25000000 0.50168898 1.0 Cu Cu3 1 0.33709903 0.25000000 0.99831102 1.0 Cu Cu4 1 0.66290097 0.75000000 0.49831102 1.0 Cu Cu5 1 0.66290097 0.75000000 0.00168898 1.0 Ge Ge6 1 0.82485740 0.25000000 0.25000000 1.0 Ge Ge7 1 0.17514260 0.75000000 0.75000000 1.0