# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9DB' 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 -5.05600 2.36200 0.45100 1.000 C1 C -4.69900 1.17400 -0.14900 1.000 C2 C -5.87900 0.59200 -0.66100 1.000 C3 C -3.33600 0.61500 -0.24200 1.000 C4 C -1.09500 0.49500 -0.57700 1.000 C5 C 0.26300 0.65600 -0.83500 1.000 C6 C 1.12800 -0.42300 -0.71700 1.000 C7 C 3.41300 -0.91300 -0.27000 1.000 O8 O -0.16000 -4.07300 0.32900 1.000 C9 C -1.05500 -3.25100 0.28100 1.000 N10 N -2.29900 -3.68700 0.57900 1.000 N11 N -3.52700 -3.03400 0.62200 1.000 C12 C -3.87500 -1.80000 0.40000 1.000 C13 C -2.99200 -0.69200 0.00200 1.000 N14 N -6.87800 1.38500 -0.38100 1.000 N15 N -6.39100 2.49600 0.31800 1.000 C16 C -7.19400 3.61700 0.81300 1.000 C17 C -1.54200 -0.77500 -0.21400 1.000 N18 N -2.20100 1.32100 -0.59300 1.000 C19 C -0.67600 -1.87300 -0.09800 1.000 C20 C 0.67400 -1.69100 -0.35300 1.000 N21 N 2.49000 -0.23700 -0.98200 1.000 O22 O 3.06400 -1.74400 0.54200 1.000 C23 C 4.87900 -0.63700 -0.48300 1.000 N24 N 5.66800 -1.77300 0.01300 1.000 C25 C 5.27500 0.63000 0.27800 1.000 C26 C 6.76400 0.91000 0.06200 1.000 C27 C 7.16000 2.17700 0.82400 1.000 C28 C 6.33800 3.36000 0.30800 1.000 C29 C 4.85000 3.07900 0.52400 1.000 C30 C 4.45400 1.81200 -0.23700 1.000 H31 H -4.39000 3.05600 0.94200 1.000 H32 H -5.94400 -0.34600 -1.19100 1.000 H33 H 0.64700 1.62500 -1.11900 1.000 H34 H -2.34400 -4.62900 0.80400 1.000 H35 H -4.92400 -1.56600 0.50800 1.000 H36 H -7.25600 4.38700 0.04400 1.000 H37 H -8.19700 3.26600 1.05600 1.000 H38 H -6.72800 4.03100 1.70700 1.000 H39 H -2.18300 2.26500 -0.81600 1.000 H40 H 1.36400 -2.51800 -0.27200 1.000 H41 H 2.76900 0.37800 -1.67800 1.000 H42 H 5.07200 -0.49700 -1.54600 1.000 H43 H 5.50700 -1.92300 0.99700 1.000 H44 H 5.47200 -2.60900 -0.51800 1.000 H45 H 5.08300 0.48900 1.34200 1.000 H46 H 7.35000 0.06700 0.43000 1.000 H47 H 6.95700 1.05000 -1.00100 1.000 H48 H 6.96700 2.03700 1.88700 1.000 H49 H 8.22100 2.37600 0.67000 1.000 H50 H 6.62100 4.26200 0.85000 1.000 H51 H 6.53100 3.50000 -0.75600 1.000 H52 H 4.65700 2.93900 1.58700 1.000 H53 H 4.26400 3.92200 0.15600 1.000 H54 H 4.64700 1.95300 -1.30100 1.000 H55 H 3.39300 1.61300 -0.08300 1.000