# generated using pymatgen data_H2INO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.86515256 _cell_length_b 9.86515256 _cell_length_c 9.86515256 _cell_angle_alpha 136.47613303 _cell_angle_beta 136.47613303 _cell_angle_gamma 63.24507882 _symmetry_Int_Tables_number 1 _chemical_formula_structural H2INO2 _chemical_formula_sum 'H8 I4 N4 O8' _cell_volume 449.50137166 _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 H H0 1 0.88102400 0.62341000 0.35719100 1.0 H H1 1 0.26621800 0.52383300 0.64280900 1.0 H H2 1 0.37341000 0.51621800 0.24238600 1.0 H H3 1 0.86897600 0.62659000 0.14280900 1.0 H H4 1 0.27383300 0.13102400 0.75761400 1.0 H H5 1 0.48378200 0.72616700 0.85719100 1.0 H H6 1 0.37659000 0.73378200 0.25761400 1.0 H H7 1 0.47616700 0.11897600 0.74238600 1.0 I I8 1 0.37500000 0.12500000 0.25000000 1.0 I I9 1 0.87500000 0.12500000 0.75000000 1.0 I I10 1 0.87500000 0.12500000 0.25000000 1.0 I I11 1 0.87500000 0.62500000 0.75000000 1.0 N N12 1 0.87500000 0.62500000 0.25000000 1.0 N N13 1 0.37500000 0.62500000 0.75000000 1.0 N N14 1 0.37500000 0.62500000 0.25000000 1.0 N N15 1 0.37500000 0.12500000 0.75000000 1.0 O O16 1 0.31439000 0.27821200 0.12960400 1.0 O O17 1 0.14860800 0.18478700 0.87039600 1.0 O O18 1 0.02821200 0.39860800 0.46382100 1.0 O O19 1 0.43561000 0.97178800 0.37039600 1.0 O O20 1 0.93478700 0.56439000 0.53617900 1.0 O O21 1 0.60139200 0.06521300 0.62960400 1.0 O O22 1 0.72178800 0.85139200 0.03617900 1.0 O O23 1 0.81521300 0.68561000 0.96382100 1.0