# generated using pymatgen data_BaPa(CuGe)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.25354925 _cell_length_b 4.25354922 _cell_length_c 17.13262109 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00001540 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaPa(CuGe)2 _chemical_formula_sum 'Ba2 Pa2 Cu4 Ge4' _cell_volume 268.44622616 _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 0.00000000 0.00000000 0.75000000 1.0 Ba Ba1 1 0.00000000 0.00000000 0.25000000 1.0 Pa Pa2 1 0.00000000 0.00000000 0.50000000 1.0 Pa Pa3 1 0.00000000 0.00000000 0.00000000 1.0 Cu Cu4 1 0.33333300 0.66666700 0.40094305 1.0 Cu Cu5 1 0.66666700 0.33333300 0.90094305 1.0 Cu Cu6 1 0.33333300 0.66666700 0.09905695 1.0 Cu Cu7 1 0.66666700 0.33333300 0.59905695 1.0 Ge Ge8 1 0.33333300 0.66666700 0.60447033 1.0 Ge Ge9 1 0.66666700 0.33333300 0.39552967 1.0 Ge Ge10 1 0.66666700 0.33333300 0.10447033 1.0 Ge Ge11 1 0.33333300 0.66666700 0.89552967 1.0