# generated using pymatgen data_TaZn2CuO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.43338300 _cell_length_b 5.39327500 _cell_length_c 5.62098833 _cell_angle_alpha 78.45502677 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaZn2CuO6 _chemical_formula_sum 'Ta2 Zn4 Cu2 O12' _cell_volume 220.78774863 _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 Ta Ta0 1 0.00000000 0.00000000 0.50000000 1.0 Ta Ta1 1 0.50000000 0.00000000 0.50000000 1.0 Zn Zn2 1 0.75000000 0.96776800 0.04436900 1.0 Zn Zn3 1 0.75000000 0.48833500 0.55797400 1.0 Zn Zn4 1 0.25000000 0.51166500 0.44202600 1.0 Zn Zn5 1 0.25000000 0.03223200 0.95563100 1.0 Cu Cu6 1 0.00000000 0.50000000 0.00000000 1.0 Cu Cu7 1 0.50000000 0.50000000 0.00000000 1.0 O O8 1 0.44160900 0.17826700 0.15907600 1.0 O O9 1 0.57443900 0.71548100 0.35036200 1.0 O O10 1 0.55839100 0.82173300 0.84092400 1.0 O O11 1 0.07443900 0.28451900 0.64963800 1.0 O O12 1 0.25000000 0.85606300 0.53637800 1.0 O O13 1 0.42556100 0.28451900 0.64963800 1.0 O O14 1 0.92556100 0.71548100 0.35036200 1.0 O O15 1 0.05839100 0.17826700 0.15907600 1.0 O O16 1 0.75000000 0.37205600 0.92783900 1.0 O O17 1 0.94160900 0.82173300 0.84092400 1.0 O O18 1 0.25000000 0.62794400 0.07216100 1.0 O O19 1 0.75000000 0.14393700 0.46362200 1.0