# generated using pymatgen data_TiZnO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.82238600 _cell_length_b 8.89095071 _cell_length_c 9.04829088 _cell_angle_alpha 92.64090981 _cell_angle_beta 98.94762759 _cell_angle_gamma 98.79995089 _symmetry_Int_Tables_number 1 _chemical_formula_structural TiZnO2 _chemical_formula_sum 'Ti4 Zn4 O8' _cell_volume 221.08328446 _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 Ti Ti0 1 0.34600000 0.67275700 0.01259600 1.0 Ti Ti1 1 0.11653200 0.90980800 0.32029400 1.0 Ti Ti2 1 0.88346800 0.09019200 0.67970600 1.0 Ti Ti3 1 0.65400000 0.32724300 0.98740400 1.0 Zn Zn4 1 0.90787000 0.51075700 0.32896900 1.0 Zn Zn5 1 0.09213000 0.48924300 0.67103100 1.0 Zn Zn6 1 0.29999200 0.25579900 0.35427300 1.0 Zn Zn7 1 0.70000800 0.74420100 0.64572700 1.0 O O8 1 0.03295400 0.21988500 0.85037200 1.0 O O9 1 0.32199000 0.93861900 0.70353000 1.0 O O10 1 0.67801000 0.06138100 0.29647000 1.0 O O11 1 0.96704600 0.78011500 0.14962800 1.0 O O12 1 0.79154400 0.70442800 0.87586800 1.0 O O13 1 0.62781400 0.81660100 0.43215000 1.0 O O14 1 0.20845600 0.29557200 0.12413200 1.0 O O15 1 0.37218600 0.18339900 0.56785000 1.0