# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'DRO' 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 3.14000 2.81200 -0.71400 1.000 C1 C 3.94400 3.89700 -1.00500 1.000 C2 C 5.31700 3.79300 -0.88500 1.000 C3 C 5.89100 2.60300 -0.47400 1.000 C4 C 5.09200 1.51500 -0.18200 1.000 C5 C 3.71200 1.61600 -0.30100 1.000 N6 N 2.90000 0.51500 -0.00500 1.000 C7 C 2.80200 0.05200 1.31200 1.000 C8 C 3.35100 -1.17600 1.66100 1.000 C9 C 3.25300 -1.63000 2.96100 1.000 C10 C 2.60800 -0.86500 3.91500 1.000 C11 C 2.06000 0.35700 3.57200 1.000 C12 C 2.16100 0.82000 2.27400 1.000 C13 C 2.21300 -0.09900 -0.98800 1.000 O14 O 2.36000 0.25200 -2.14300 1.000 C15 C 1.28100 -1.19600 -0.66300 1.000 N16 N 0.07300 -1.07200 -0.15000 1.000 C17 C 1.51500 -2.58100 -0.84900 1.000 Cl18 Cl 2.94100 -3.32800 -1.49900 1.000 C19 C 0.39200 -3.20000 -0.41300 1.000 C20 C 0.13700 -4.68500 -0.39800 1.000 N21 N -0.46300 -2.22900 0.00600 1.000 C22 C -1.73900 -2.45700 0.52700 1.000 C23 C -1.92700 -3.40800 1.51900 1.000 C24 C -3.18900 -3.63200 2.03300 1.000 C25 C -4.27500 -2.91100 1.56300 1.000 C26 C -4.10600 -1.96100 0.57800 1.000 C27 C -2.83400 -1.72000 0.05400 1.000 C28 C -2.64600 -0.70100 -0.99700 1.000 O29 O -1.96900 -0.95400 -1.97500 1.000 N30 N -3.22400 0.51000 -0.87300 1.000 C31 C -3.93800 0.89200 0.35000 1.000 C32 C -3.55000 2.29500 0.74700 1.000 C33 C -3.93200 2.74000 2.00500 1.000 C34 C -3.61600 4.01700 2.42200 1.000 C35 C -2.91400 4.85900 1.57900 1.000 C36 C -2.53000 4.41600 0.33100 1.000 C37 C -2.84200 3.12800 -0.08900 1.000 C38 C -2.36600 2.70400 -1.45400 1.000 C39 C -3.15800 1.50500 -1.95600 1.000 C40 C -2.45600 0.89900 -3.17300 1.000 N41 N -3.26100 -0.21100 -3.70100 1.000 H42 H 2.06600 2.89500 -0.80400 1.000 H43 H 3.49900 4.82700 -1.32600 1.000 H44 H 5.94400 4.64200 -1.11300 1.000 H45 H 6.96400 2.52500 -0.38200 1.000 H46 H 5.54100 0.58600 0.13900 1.000 H47 H 3.85500 -1.77400 0.91600 1.000 H48 H 1.73700 1.77700 2.00800 1.000 H49 H 3.68000 -2.58400 3.23300 1.000 H50 H 2.53200 -1.22300 4.93200 1.000 H51 H 1.55700 0.95200 4.31900 1.000 H52 H 0.39200 -5.08800 0.58200 1.000 H53 H -0.91600 -4.87500 -0.60600 1.000 H54 H 0.75100 -5.16700 -1.15900 1.000 H55 H -1.08600 -3.97500 1.89000 1.000 H56 H -3.33100 -4.37400 2.80500 1.000 H57 H -5.25800 -3.09400 1.97100 1.000 H58 H -4.95500 -1.40200 0.21500 1.000 H59 H -5.01200 0.85000 0.17100 1.000 H60 H -3.67800 0.20300 1.15300 1.000 H61 H -4.16500 1.81900 -2.23000 1.000 H62 H -4.48200 2.08300 2.66300 1.000 H63 H -3.91600 4.35700 3.40200 1.000 H64 H -2.66700 5.86100 1.89700 1.000 H65 H -1.98200 5.07500 -0.32600 1.000 H66 H -2.48900 3.53400 -2.15000 1.000 H67 H -1.31100 2.43700 -1.39800 1.000 H68 H -2.34000 1.66200 -3.94300 1.000 H69 H -1.47400 0.52800 -2.87900 1.000 H70 H -2.73600 -0.75000 -4.37300 1.000 H71 H -3.60100 -0.79800 -2.95400 1.000