# generated using pymatgen data_BaCu9Ge4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.45183608 _cell_length_b 8.45183608 _cell_length_c 8.45183608 _cell_angle_alpha 120.61182246 _cell_angle_beta 120.61182246 _cell_angle_gamma 88.94351927 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaCu9Ge4 _chemical_formula_sum 'Ba2 Cu18 Ge8' _cell_volume 422.88592286 _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 Ba Ba0 1 0.25000000 0.25000000 0.00000000 1.0 Ba Ba1 1 0.75000000 0.75000000 0.00000000 1.0 Cu Cu2 1 0.06094600 0.56094600 0.26645100 1.0 Cu Cu3 1 0.70550500 0.20550500 0.26645100 1.0 Cu Cu4 1 0.93905400 0.43905400 0.73354900 1.0 Cu Cu5 1 0.43905400 0.70550500 0.50000000 1.0 Cu Cu6 1 0.20550500 0.93905400 0.50000000 1.0 Cu Cu7 1 0.56094600 0.29449500 0.50000000 1.0 Cu Cu8 1 0.79449500 0.06094600 0.50000000 1.0 Cu Cu9 1 0.29449500 0.79449500 0.73354900 1.0 Cu Cu10 1 0.43838300 0.29585900 0.73424200 1.0 Cu Cu11 1 0.79585900 0.93838300 0.73424200 1.0 Cu Cu12 1 0.00000000 0.50000000 0.50000000 1.0 Cu Cu13 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu14 1 0.56161700 0.70414100 0.26575800 1.0 Cu Cu15 1 0.70414100 0.43838300 0.14252400 1.0 Cu Cu16 1 0.29585900 0.56161700 0.85747600 1.0 Cu Cu17 1 0.93838300 0.20414100 0.14252400 1.0 Cu Cu18 1 0.06161700 0.79585900 0.85747600 1.0 Cu Cu19 1 0.20414100 0.06161700 0.26575800 1.0 Ge Ge20 1 0.79928400 0.29928400 0.85704500 1.0 Ge Ge21 1 0.55776100 0.05776100 0.85704500 1.0 Ge Ge22 1 0.20071600 0.70071600 0.14295500 1.0 Ge Ge23 1 0.70071600 0.55776100 0.50000000 1.0 Ge Ge24 1 0.05776100 0.20071600 0.50000000 1.0 Ge Ge25 1 0.29928400 0.44223900 0.50000000 1.0 Ge Ge26 1 0.94223900 0.79928400 0.50000000 1.0 Ge Ge27 1 0.44223900 0.94223900 0.14295500 1.0