# generated using pymatgen data_ZnNiO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.02288856 _cell_length_b 8.54859924 _cell_length_c 6.04376628 _cell_angle_alpha 90.02694507 _cell_angle_beta 90.00001341 _cell_angle_gamma 90.00000474 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZnNiO2 _chemical_formula_sum 'Zn4 Ni4 O8' _cell_volume 156.17974439 _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 0.50000000 0.75000000 0.75000000 1.0 Zn Zn1 1 0.00000000 0.50000000 0.00000000 1.0 Zn Zn2 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn3 1 0.50000000 0.25000000 0.25000000 1.0 Ni Ni4 1 0.50000000 0.75000000 0.25000000 1.0 Ni Ni5 1 0.00000000 0.50000000 0.50000000 1.0 Ni Ni6 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni7 1 0.50000000 0.25000000 0.75000000 1.0 O O8 1 0.00000000 0.74822600 0.49645100 1.0 O O9 1 0.50000000 0.49822600 0.74645100 1.0 O O10 1 0.50000000 0.99822600 0.24645100 1.0 O O11 1 0.00000000 0.24822600 0.99645100 1.0 O O12 1 0.00000000 0.75177400 0.00354900 1.0 O O13 1 0.50000000 0.50177400 0.25354900 1.0 O O14 1 0.50000000 0.00177400 0.75354900 1.0 O O15 1 0.00000000 0.25177400 0.50354900 1.0