# generated using pymatgen data_Zr2N2O _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.15170100 _cell_length_b 8.55525200 _cell_length_c 8.60528800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr2N2O _chemical_formula_sum 'Zr8 N8 O4' _cell_volume 232.02951154 _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 Zr Zr0 1 0.25000000 0.00129200 0.18177600 1.0 Zr Zr1 1 0.75000000 0.17875700 0.49469600 1.0 Zr Zr2 1 0.75000000 0.32124400 0.99469600 1.0 Zr Zr3 1 0.25000000 0.49870800 0.68177600 1.0 Zr Zr4 1 0.75000000 0.50129200 0.31822400 1.0 Zr Zr5 1 0.25000000 0.67875600 0.00530400 1.0 Zr Zr6 1 0.25000000 0.82124400 0.50530400 1.0 Zr Zr7 1 0.75000000 0.99870800 0.81822400 1.0 N N8 1 0.25000000 0.05551600 0.62433100 1.0 N N9 1 0.25000000 0.13301700 0.95235500 1.0 N N10 1 0.25000000 0.36698300 0.45235500 1.0 N N11 1 0.25000000 0.44448400 0.12433100 1.0 N N12 1 0.75000000 0.55551600 0.87566900 1.0 N N13 1 0.75000000 0.63301700 0.54764500 1.0 N N14 1 0.75000000 0.86698300 0.04764500 1.0 N N15 1 0.75000000 0.94448400 0.37566900 1.0 O O16 1 0.75000000 0.19006300 0.22627000 1.0 O O17 1 0.75000000 0.30993700 0.72627000 1.0 O O18 1 0.25000000 0.69006300 0.27373000 1.0 O O19 1 0.25000000 0.80993700 0.77373000 1.0