# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '064' 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 4.82600 0.31200 0.40700 1.000 N1 N 5.97500 -0.23600 0.71800 1.000 C2 C 4.52800 -1.46900 1.64100 1.000 C3 C 2.33000 -0.31200 0.97400 1.000 C4 C 5.08200 1.59000 -1.71900 1.000 C5 C 3.93800 2.62700 0.13300 1.000 C6 C 3.96300 -2.60800 2.45000 1.000 C7 C 4.38200 -3.93800 1.82000 1.000 C8 C 4.49800 -2.53000 3.88100 1.000 C9 C 0.43300 -1.07300 -0.23900 1.000 C10 C 4.21000 3.81200 -1.93200 1.000 C11 C -0.16600 -1.83700 -1.23200 1.000 C12 C -0.34100 -0.26300 0.58200 1.000 C13 C -1.53300 -1.79000 -1.41200 1.000 C14 C -1.70800 -0.21300 0.41400 1.000 C15 C -2.31500 -0.97100 -0.59100 1.000 C16 C -3.77600 -0.92000 -0.77400 1.000 C17 C -4.52700 -0.14500 0.02500 1.000 C18 C -5.98800 -0.09400 -0.15900 1.000 C19 C -6.77000 0.71000 0.67100 1.000 C20 C -6.59500 -0.84900 -1.16800 1.000 C21 C -7.96400 -0.80200 -1.34000 1.000 C22 C 3.82500 -0.49700 1.01600 1.000 C23 C 4.61100 1.53300 -0.40800 1.000 O24 O 5.82300 -1.22200 1.40000 1.000 O25 O 1.77900 -1.12300 -0.06600 1.000 C26 C 4.87900 2.73000 -2.47400 1.000 Cl27 Cl 5.92900 0.23600 -2.40000 1.000 C28 C 3.74100 3.76100 -0.63200 1.000 Cl29 Cl 3.34700 2.56500 1.76400 1.000 Cl30 Cl -2.28000 -2.74400 -2.65400 1.000 C31 C -8.15100 0.75200 0.49000 1.000 C32 C -8.74300 -0.01200 -0.52000 1.000 C33 C -8.98700 1.60100 1.36300 1.000 O34 O -8.47000 2.26400 2.24000 1.000 O35 O -10.32200 1.64000 1.18700 1.000 H36 H 1.90100 -0.60800 1.93100 1.000 H37 H 2.09800 0.73500 0.77900 1.000 H38 H 2.87600 -2.53900 2.46500 1.000 H39 H 5.47000 -4.00600 1.80600 1.000 H40 H 3.97400 -4.76100 2.40500 1.000 H41 H 4.00100 -3.99300 0.80000 1.000 H42 H 4.20000 -1.58300 4.33000 1.000 H43 H 4.09000 -3.35400 4.46700 1.000 H44 H 5.58600 -2.59900 3.86700 1.000 H45 H 4.05400 4.70000 -2.52500 1.000 H46 H 0.43900 -2.46900 -1.86500 1.000 H47 H 0.13000 0.32900 1.35300 1.000 H48 H -2.30800 0.41800 1.05300 1.000 H49 H -4.24300 -1.50700 -1.55100 1.000 H50 H -4.05900 0.44200 0.80200 1.000 H51 H -6.30700 1.29800 1.44900 1.000 H52 H -5.99100 -1.46900 -1.81400 1.000 H53 H -8.42700 -1.38600 -2.12200 1.000 H54 H 5.24400 2.77500 -3.49000 1.000 H55 H 3.21800 4.60900 -0.21400 1.000 H56 H -9.81400 0.01900 -0.66100 1.000 H57 H -10.82700 2.21000 1.78300 1.000