# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C51' 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 -4.06300 0.04600 0.59200 1.000 C1 C -5.22600 0.11500 1.35300 1.000 C2 C -6.35900 -0.55200 0.94300 1.000 C3 C -6.34000 -1.29700 -0.23900 1.000 C4 C -5.17000 -1.36300 -1.00100 1.000 C5 C -7.51600 -1.99200 -0.66800 1.000 C6 C 2.81500 -0.84200 1.42800 1.000 C7 C 3.60000 -1.79000 2.08000 1.000 C8 C 5.30800 -1.55600 0.54600 1.000 C9 C 7.08600 -1.32200 -1.03900 1.000 C10 C -0.00500 2.37600 -0.67400 1.000 C11 C 0.29100 1.20500 -1.61400 1.000 C12 C 1.13400 0.16100 -0.88000 1.000 C13 C 2.45000 0.79600 -0.42600 1.000 C14 C 2.15500 1.96600 0.51400 1.000 C15 C 1.31100 3.01000 -0.22100 1.000 C16 C 3.28000 -0.23300 0.29700 1.000 C17 C -0.77300 1.86700 0.54700 1.000 C18 C -1.06900 3.03700 1.48800 1.000 C19 C -2.07000 1.24200 0.10100 1.000 N20 N -2.91600 0.72200 1.01200 1.000 O21 O -2.35100 1.20700 -1.07900 1.000 C22 C -4.03900 -0.69800 -0.58200 1.000 N23 N -8.44900 -2.54300 -1.00900 1.000 N24 N 4.79100 -2.11800 1.64300 1.000 C25 C 4.55800 -0.59200 -0.17200 1.000 C26 C 6.58600 -1.91200 0.08100 1.000 C27 C 6.35100 -0.36700 -1.73700 1.000 C28 C 5.10500 -0.00400 -1.32400 1.000 H29 H -5.23900 0.69100 2.26700 1.000 H30 H -7.26100 -0.49900 1.53500 1.000 H31 H -5.15200 -1.93800 -1.91500 1.000 H32 H 1.83700 -0.59300 1.81200 1.000 H33 H 3.21700 -2.26600 2.97100 1.000 H34 H 8.06900 -1.59900 -1.39100 1.000 H35 H -0.60500 3.12000 -1.19700 1.000 H36 H -0.64700 0.75300 -1.93700 1.000 H37 H 0.83800 1.56800 -2.48400 1.000 H38 H 0.58600 -0.20100 -0.01000 1.000 H39 H 1.34400 -0.67300 -1.55000 1.000 H40 H 2.99700 1.15800 -1.29600 1.000 H41 H 1.60700 1.60400 1.38400 1.000 H42 H 3.09200 2.41800 0.83700 1.000 H43 H 1.85900 3.37200 -1.09100 1.000 H44 H 1.10100 3.84400 0.44900 1.000 H45 H -0.17300 1.12300 1.07100 1.000 H46 H -1.61600 2.67500 2.35800 1.000 H47 H -0.13100 3.48900 1.81100 1.000 H48 H -1.66900 3.78100 0.96400 1.000 H49 H -2.72800 0.81800 1.95800 1.000 H50 H -3.13500 -0.74900 -1.17000 1.000 H51 H 7.16900 -2.65000 0.61200 1.000 H52 H 6.77100 0.08600 -2.62300 1.000 H53 H 4.54200 0.73200 -1.87800 1.000