# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0HL' 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 -1.88700 0.76900 -0.13200 1.000 C1 C -3.18500 1.28600 -0.28400 1.000 C2 C -4.26300 0.77800 0.46000 1.000 C3 C -5.51100 1.30500 0.28600 1.000 O4 O -6.55300 0.81200 1.00600 1.000 C5 C -7.83400 1.40400 0.78100 1.000 C6 C -5.73100 2.34500 -0.62300 1.000 C7 C -4.70800 2.85900 -1.35700 1.000 C8 C -3.41100 2.34000 -1.20500 1.000 C9 C -2.33100 2.84800 -1.94700 1.000 C10 C -1.08700 2.32200 -1.77400 1.000 C11 C -0.86500 1.29000 -0.86500 1.000 S12 S 0.76100 0.63900 -0.67200 1.000 O13 O 0.61700 -0.61300 -0.01400 1.000 O14 O 1.40400 0.78500 -1.93100 1.000 N15 N 1.56400 1.63100 0.38200 1.000 C16 C 2.24400 2.83100 -0.11400 1.000 C17 C 3.70000 2.52100 -0.35000 1.000 C18 C 4.16600 2.00000 -1.54500 1.000 C19 C 5.48100 1.78500 -1.58900 1.000 S20 S 6.20700 2.25400 -0.05700 1.000 C21 C 4.63700 2.73500 0.57300 1.000 C22 C 1.59500 1.31100 1.81100 1.000 C23 C 0.51200 0.31100 2.15300 1.000 O24 O -0.66400 0.57900 2.28200 1.000 C25 C 2.91000 0.58300 2.17400 1.000 C26 C 2.49100 -0.90000 2.06100 1.000 N27 N 1.04200 -0.91600 2.29300 1.000 C28 C 0.27300 -2.11500 2.63200 1.000 C29 C -0.12500 -2.83100 1.36600 1.000 C30 C 0.71700 -3.70700 0.71700 1.000 C31 C -1.32200 -2.66800 0.79500 1.000 S32 S -1.45800 -3.61400 -0.61800 1.000 C33 C 0.16800 -4.24800 -0.40800 1.000 C34 C 0.83000 -5.21200 -1.30100 1.000 N35 N 2.04600 -5.61500 -1.04100 1.000 N36 N 0.16800 -5.68900 -2.41400 1.000 H37 H -1.70100 -0.03400 0.56600 1.000 H38 H -4.10600 -0.02500 1.16400 1.000 H39 H -7.79000 2.46700 1.01900 1.000 H40 H -8.11500 1.27700 -0.26500 1.000 H41 H -8.57500 0.92000 1.41700 1.000 H42 H -6.72600 2.74600 -0.74300 1.000 H43 H -4.89300 3.66200 -2.05600 1.000 H44 H -2.48800 3.65000 -2.65300 1.000 H45 H -0.25900 2.71700 -2.34300 1.000 H46 H 1.78300 3.14800 -1.05000 1.000 H47 H 2.15700 3.62900 0.62300 1.000 H48 H 3.51300 1.78300 -2.37800 1.000 H49 H 6.01800 1.38300 -2.43500 1.000 H50 H 4.45900 3.13700 1.56000 1.000 H51 H 1.48100 2.21600 2.40700 1.000 H52 H 3.69800 0.82100 1.45900 1.000 H53 H 3.22200 0.82400 3.19000 1.000 H54 H 2.71900 -1.28100 1.06600 1.000 H55 H 3.00100 -1.49400 2.82000 1.000 H56 H 0.88200 -2.77700 3.24700 1.000 H57 H -0.62300 -1.82900 3.18300 1.000 H58 H 1.71200 -3.94100 1.06400 1.000 H59 H -2.09900 -2.02200 1.17700 1.000 H60 H 2.48200 -6.25000 -1.63000 1.000 H61 H -0.73400 -5.39000 -2.60700 1.000 H62 H 0.60400 -6.32400 -3.00300 1.000