# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9DK' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy C0 C 3.81800 -0.53500 0.11800 1.000 C1 C 2.74200 0.50100 -0.08400 1.000 C2 C 2.87800 1.59100 0.98100 1.000 C3 C 2.88900 1.12400 -1.47300 1.000 C4 C 1.38900 -0.15100 0.03400 1.000 C5 C -1.04600 -0.04600 0.00400 1.000 C6 C -2.13800 1.00500 -0.20100 1.000 C7 C -3.49100 0.35400 -0.08300 1.000 C8 C -4.48300 0.73300 0.74600 1.000 C9 C -5.13900 -0.99700 -0.42300 1.000 N10 N 0.27000 0.58700 -0.11100 1.000 N11 N -5.52800 -0.12400 0.53100 1.000 N12 N -3.92200 -0.70200 -0.78900 1.000 O13 O 3.51600 -1.68600 0.33100 1.000 O14 O 1.30600 -1.34000 0.26000 1.000 H15 H 3.85700 2.06200 0.89600 1.000 H16 H 2.10000 2.34000 0.83500 1.000 H17 H 2.77400 1.14700 1.97100 1.000 H18 H 2.79200 0.34700 -2.23200 1.000 H19 H 2.11100 1.87300 -1.61900 1.000 H20 H 3.86800 1.59500 -1.55900 1.000 H21 H -1.15000 -0.49000 0.99400 1.000 H22 H -1.14200 -0.82300 -0.75500 1.000 H23 H -2.04100 1.78200 0.55800 1.000 H24 H -2.03300 1.44900 -1.19100 1.000 H25 H -4.45700 1.55500 1.44600 1.000 H26 H -5.73800 -1.80400 -0.82000 1.000 H27 H 0.33700 1.53800 -0.29200 1.000 H28 H -6.38800 -0.10700 0.98000 1.000 O29 O 5.11100 -0.18100 0.05600 1.000 H30 H 5.76500 -0.88000 0.19200 1.000