# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'H36' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N 7.10400 -0.91200 -0.26900 1.000 C1 C 6.56000 0.25100 -0.02700 1.000 C2 C 7.40600 1.39700 0.33600 1.000 S3 S 6.82900 3.02000 0.69100 1.000 C4 C 8.41700 3.57500 0.97300 1.000 C5 C 9.30400 2.58900 0.80500 1.000 C6 C 8.76400 1.37100 0.45700 1.000 N7 N 5.18900 0.40300 -0.11200 1.000 C8 C 4.39900 -0.64000 -0.60100 1.000 C9 C 3.15500 -0.89300 -0.03900 1.000 C10 C 4.85400 -1.42200 -1.65500 1.000 C11 C 4.07300 -2.45400 -2.13900 1.000 C12 C 2.83700 -2.71000 -1.57700 1.000 C13 C 2.37400 -1.92800 -0.52700 1.000 O14 O 1.15800 -2.18200 0.02500 1.000 C15 C 0.41000 -3.26800 -0.52500 1.000 C16 C -0.92000 -3.39900 0.22000 1.000 O17 O -1.71500 -2.23500 -0.01600 1.000 C18 C -2.93600 -2.19100 0.57700 1.000 C19 C -3.36100 -3.24800 1.37100 1.000 C20 C -4.60300 -3.20500 1.97500 1.000 C21 C -5.42600 -2.11000 1.79100 1.000 C22 C -3.75600 -1.08900 0.39500 1.000 C23 C -5.00600 -1.05000 0.99800 1.000 N24 N -5.83900 0.05800 0.81300 1.000 C25 C -5.96400 0.62500 -0.44000 1.000 N26 N -5.39900 0.05900 -1.47400 1.000 C27 C -6.73300 1.86700 -0.61200 1.000 S28 S -7.54900 2.74700 0.67300 1.000 C29 C -8.10200 3.93100 -0.42400 1.000 C30 C -7.68900 3.66100 -1.66600 1.000 C31 C -6.92300 2.52300 -1.79200 1.000 H32 H 8.06600 -1.02000 -0.21000 1.000 H33 H 8.67200 4.58700 1.24900 1.000 H34 H 10.36600 2.73600 0.93700 1.000 H35 H 9.35700 0.48300 0.29400 1.000 H36 H 4.77600 1.23500 0.16900 1.000 H37 H 2.79700 -0.28400 0.77800 1.000 H38 H 5.82000 -1.22400 -2.09700 1.000 H39 H 4.42800 -3.06000 -2.95900 1.000 H40 H 2.22800 -3.51700 -1.95800 1.000 H41 H 0.21900 -3.07900 -1.58100 1.000 H42 H 0.97900 -4.19200 -0.41800 1.000 H43 H -1.45200 -4.28000 -0.13900 1.000 H44 H -0.73000 -3.49900 1.28800 1.000 H45 H -2.72000 -4.10500 1.51600 1.000 H46 H -4.93200 -4.02900 2.59100 1.000 H47 H -6.39800 -2.08100 2.26100 1.000 H48 H -3.42500 -0.26400 -0.21800 1.000 H49 H -6.32800 0.42800 1.56400 1.000 H50 H -4.99000 -0.81600 -1.38400 1.000 H51 H -8.70600 4.78400 -0.15200 1.000 H52 H -7.93500 4.29100 -2.50800 1.000 H53 H -6.52000 2.18000 -2.73300 1.000