# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '062' 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 -4.86200 1.45300 2.41600 1.000 C1 C -4.90800 0.15800 2.17400 1.000 C2 C -4.32600 -0.36600 1.02100 1.000 C3 C -3.70000 0.50900 0.13200 1.000 C4 C -3.67200 1.85600 0.42700 1.000 C5 C -4.27200 2.30000 1.59300 1.000 C6 C -4.22800 -1.75100 0.50000 1.000 C7 C -3.53900 -1.74300 -0.71000 1.000 C8 C -3.16500 -0.31200 -1.01200 1.000 C9 C -4.69200 -2.96300 1.01400 1.000 C10 C -4.46600 -4.13600 0.32500 1.000 C11 C -3.78100 -4.11800 -0.87700 1.000 C12 C -3.31900 -2.92000 -1.39300 1.000 O13 O -3.76600 0.10600 -2.24000 1.000 C14 C -1.66700 -0.17300 -1.09500 1.000 N15 N -1.12200 0.85600 -1.77400 1.000 C16 C 0.31500 1.18000 -1.83800 1.000 C17 C 0.36800 2.69300 -2.16700 1.000 C18 C -0.83100 2.84300 -3.14000 1.000 C19 C -1.86300 1.84500 -2.57300 1.000 C20 C 0.97400 0.90900 -0.51000 1.000 N21 N 2.29200 0.63600 -0.45500 1.000 C22 C 2.93300 0.37200 0.83600 1.000 C23 C 4.39900 0.09700 0.62300 1.000 C24 C 4.86300 -1.20500 0.61000 1.000 C25 C 6.20900 -1.45800 0.41400 1.000 C26 C 7.08900 -0.40700 0.22700 1.000 C27 C 6.62300 0.89400 0.23500 1.000 C28 C 5.27800 1.14600 0.43000 1.000 Cl29 Cl 6.79400 -3.09200 0.40500 1.000 C30 C 4.77000 2.56500 0.43800 1.000 N31 N 4.59000 3.01200 1.82600 1.000 O32 O -5.46300 1.95200 3.59800 1.000 O33 O -0.95200 -0.98700 -0.55100 1.000 O34 O 0.31700 0.93600 0.51000 1.000 H35 H -5.40000 -0.50100 2.87400 1.000 H36 H -3.19200 2.55400 -0.24300 1.000 H37 H -4.25800 3.35400 1.83100 1.000 H38 H -5.22800 -2.98200 1.95200 1.000 H39 H -4.82600 -5.07300 0.72400 1.000 H40 H -3.60700 -5.03900 -1.41300 1.000 H41 H -2.78400 -2.90800 -2.33200 1.000 H42 H -3.74300 1.07200 -2.24800 1.000 H43 H 0.79900 0.60300 -2.62600 1.000 H44 H 0.22000 3.29300 -1.26900 1.000 H45 H 1.30600 2.95300 -2.65900 1.000 H46 H -1.22300 3.85900 -3.11500 1.000 H47 H -0.54200 2.56400 -4.15300 1.000 H48 H -2.57900 2.37100 -1.94200 1.000 H49 H -2.38300 1.34500 -3.39000 1.000 H50 H 2.81700 0.61400 -1.27000 1.000 H51 H 2.46500 -0.49500 1.30300 1.000 H52 H 2.81700 1.24100 1.48400 1.000 H53 H 4.17600 -2.02500 0.75600 1.000 H54 H 8.14000 -0.60300 0.07400 1.000 H55 H 7.31000 1.71500 0.08800 1.000 H56 H 3.81600 2.61300 -0.08600 1.000 H57 H 5.49200 3.21200 -0.06100 1.000 H58 H 4.25100 3.96100 1.78300 1.000 H59 H 3.84300 2.45500 2.21500 1.000