# generated using pymatgen data_Zn(CuO2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.04604600 _cell_length_b 5.80478000 _cell_length_c 10.11238100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zn(CuO2)2 _chemical_formula_sum 'Zn4 Cu8 O16' _cell_volume 296.20364187 _cell_formula_units_Z 4 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 Zn Zn0 1 0.65502800 0.50000000 0.50000000 1.0 Zn Zn1 1 0.34497200 0.00000000 0.00000000 1.0 Zn Zn2 1 0.98114400 0.50000000 0.00000000 1.0 Zn Zn3 1 0.01885600 0.00000000 0.50000000 1.0 Cu Cu4 1 0.98492100 0.00000000 0.23291900 1.0 Cu Cu5 1 0.98492100 0.00000000 0.76708100 1.0 Cu Cu6 1 0.01507900 0.50000000 0.26708100 1.0 Cu Cu7 1 0.01507900 0.50000000 0.73291900 1.0 Cu Cu8 1 0.50000000 0.25000000 0.25000000 1.0 Cu Cu9 1 0.50000000 0.75000000 0.75000000 1.0 Cu Cu10 1 0.50000000 0.75000000 0.25000000 1.0 Cu Cu11 1 0.50000000 0.25000000 0.75000000 1.0 O O12 1 0.63687000 0.00000000 0.14642600 1.0 O O13 1 0.63687000 0.00000000 0.85357400 1.0 O O14 1 0.36313000 0.50000000 0.35357400 1.0 O O15 1 0.36313000 0.50000000 0.64642600 1.0 O O16 1 0.29953600 0.00000000 0.34717600 1.0 O O17 1 0.29953600 0.00000000 0.65282400 1.0 O O18 1 0.70046400 0.50000000 0.15282400 1.0 O O19 1 0.70046400 0.50000000 0.84717600 1.0 O O20 1 0.83534900 0.24898800 0.36657900 1.0 O O21 1 0.83534900 0.75101200 0.63342100 1.0 O O22 1 0.16465100 0.74898800 0.13342100 1.0 O O23 1 0.16465100 0.25101200 0.86657900 1.0 O O24 1 0.16465100 0.25101200 0.13342100 1.0 O O25 1 0.16465100 0.74898800 0.86657900 1.0 O O26 1 0.83534900 0.75101200 0.36657900 1.0 O O27 1 0.83534900 0.24898800 0.63342100 1.0