# generated using pymatgen data_Zr5N5O2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.51274903 _cell_length_b 5.51274903 _cell_length_c 18.53610024 _cell_angle_alpha 74.81869713 _cell_angle_beta 74.81869713 _cell_angle_gamma 32.86980852 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr5N5O2 _chemical_formula_sum 'Zr10 N10 O4' _cell_volume 294.11541744 _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 Zr Zr0 1 0.70030900 0.70030900 0.84584000 1.0 Zr Zr1 1 0.88951300 0.88951300 0.45903200 1.0 Zr Zr2 1 0.29593000 0.29593000 0.65433400 1.0 Zr Zr3 1 0.98929600 0.98929600 0.24640700 1.0 Zr Zr4 1 0.10906100 0.10906100 0.03917400 1.0 Zr Zr5 1 0.88607400 0.88607400 0.95987400 1.0 Zr Zr6 1 0.99884600 0.99884600 0.74871800 1.0 Zr Zr7 1 0.69844100 0.69844100 0.34915200 1.0 Zr Zr8 1 0.11418500 0.11418500 0.53718000 1.0 Zr Zr9 1 0.30742200 0.30742200 0.14800700 1.0 N N10 1 0.50393900 0.50393900 0.99486000 1.0 N N11 1 0.65482900 0.65482900 0.72137300 1.0 N N12 1 0.73816900 0.73816900 0.57179200 1.0 N N13 1 0.95354600 0.95354600 0.14195100 1.0 N N14 1 0.26654600 0.26654600 0.92288900 1.0 N N15 1 0.34126700 0.34126700 0.77485400 1.0 N N16 1 0.50696000 0.50696000 0.49455300 1.0 N N17 1 0.73774700 0.73774700 0.07251100 1.0 N N18 1 0.26553700 0.26553700 0.42495600 1.0 N N19 1 0.33881500 0.33881500 0.27690900 1.0 O O20 1 0.04612500 0.04612500 0.35322600 1.0 O O21 1 0.95479100 0.95479100 0.64143000 1.0 O O22 1 0.65460900 0.65460900 0.22485800 1.0 O O23 1 0.04549100 0.04549100 0.85419100 1.0