# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CNB' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Fe0 Fe 1.69400 0.28500 0.29000 1.000 Fe1 Fe -0.51700 0.07500 -1.54900 1.000 Fe2 Fe -1.00100 0.07000 1.29400 1.000 O3 O -0.99600 -1.52400 0.48100 1.000 O4 O -0.57100 -0.72400 2.83900 1.000 O5 O -2.50500 0.69100 2.04100 1.000 O6 O -1.45600 0.84400 -0.24500 1.000 O7 O 0.49700 1.02900 1.38000 1.000 O8 O 0.92500 1.03400 -1.13200 1.000 O9 O 2.59000 -0.33400 1.71000 1.000 O10 O 2.80000 -0.61500 -0.79200 1.000 O11 O -1.95000 -0.90100 -1.99300 1.000 O12 O -0.50900 0.79400 -3.18900 1.000 O13 O 0.39800 -1.42800 -1.22600 1.000 H14 H -0.75900 -2.17900 1.15200 1.000 H15 H 0.27400 -1.17100 2.69800 1.000 H16 H -2.50700 0.38700 2.95900 1.000 H17 H 2.72600 0.41500 2.30500 1.000 H18 H 3.69700 -0.46200 -0.46400 1.000 H19 H -1.68900 -1.45600 -2.74200 1.000 H20 H 0.03400 0.21800 -3.74400 1.000 H21 H 0.81300 -1.68600 -2.06100 1.000