# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '965' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O 10.72500 -1.05700 1.58400 1.000 C1 C 9.63600 -0.60800 0.94000 1.000 O2 O 9.06800 0.38400 1.33300 1.000 C3 C 9.12100 -1.34100 -0.27200 1.000 C4 C 7.89900 -0.63800 -0.80300 1.000 C5 C 8.03300 0.36100 -1.75000 1.000 C6 C 6.91300 1.00800 -2.23900 1.000 C7 C 5.65700 0.65900 -1.78200 1.000 C8 C 5.52000 -0.34300 -0.83200 1.000 O9 O 4.28500 -0.68900 -0.38100 1.000 C10 C 3.17200 0.02100 -0.92900 1.000 C11 C 1.87700 -0.50300 -0.30600 1.000 C12 C 0.68600 0.25700 -0.89200 1.000 N13 N -0.55800 -0.24600 -0.29400 1.000 C14 C -0.80500 -1.64000 -0.68600 1.000 C15 C -2.00800 -2.16500 0.05500 1.000 C16 C -1.84200 -2.84700 1.24600 1.000 C17 C -2.94600 -3.32800 1.92600 1.000 C18 C -4.21400 -3.12900 1.41500 1.000 C19 C -4.38100 -2.44700 0.22400 1.000 C20 C -3.27800 -1.96000 -0.45300 1.000 Cl21 Cl -3.48700 -1.09700 -1.94500 1.000 C22 C -5.76500 -2.23100 -0.33300 1.000 F23 F -6.70500 -2.84000 0.50400 1.000 F24 F -6.02700 -0.85900 -0.40900 1.000 F25 F -5.84500 -2.79300 -1.61200 1.000 C26 C -1.69700 0.61000 -0.65000 1.000 C27 C -1.49000 2.00600 -0.05800 1.000 C28 C -2.60600 2.91400 -0.50800 1.000 C29 C -2.31300 4.13500 -1.08500 1.000 C30 C -3.33700 4.96800 -1.49800 1.000 C31 C -4.65300 4.57800 -1.33500 1.000 C32 C -4.94600 3.35500 -0.76000 1.000 C33 C -3.92200 2.52100 -0.35100 1.000 C34 C -1.49000 1.91900 1.44600 1.000 C35 C -2.54300 1.31200 2.10400 1.000 C36 C -2.54300 1.23200 3.48400 1.000 C37 C -1.48900 1.75900 4.20700 1.000 C38 C -0.43600 2.36600 3.54900 1.000 C39 C -0.43400 2.44200 2.16900 1.000 C40 C 6.64400 -0.99500 -0.34700 1.000 H41 H 11.01700 -0.55400 2.35600 1.000 H42 H 9.89300 -1.35800 -1.04100 1.000 H43 H 8.86100 -2.36300 0.00500 1.000 H44 H 9.01400 0.63500 -2.10800 1.000 H45 H 7.02100 1.78800 -2.97800 1.000 H46 H 4.78300 1.16500 -2.16400 1.000 H47 H 3.27700 1.08400 -0.71100 1.000 H48 H 3.14200 -0.12800 -2.00800 1.000 H49 H 1.77300 -1.56600 -0.52300 1.000 H50 H 1.90700 -0.35400 0.77400 1.000 H51 H 0.79000 1.32000 -0.67500 1.000 H52 H 0.65500 0.10800 -1.97200 1.000 H53 H -0.99000 -1.68800 -1.75900 1.000 H54 H 0.06600 -2.24700 -0.44000 1.000 H55 H -0.85100 -3.00300 1.64500 1.000 H56 H -2.81600 -3.86100 2.85600 1.000 H57 H -5.07600 -3.50600 1.94700 1.000 H58 H -1.77300 0.68300 -1.73500 1.000 H59 H -2.61500 0.17900 -0.25000 1.000 H60 H -0.53600 2.40700 -0.39900 1.000 H61 H -1.28500 4.44000 -1.21200 1.000 H62 H -3.10800 5.92300 -1.94700 1.000 H63 H -5.45300 5.22800 -1.65700 1.000 H64 H -5.97400 3.05100 -0.63200 1.000 H65 H -4.15100 1.56500 0.09500 1.000 H66 H -3.36700 0.90000 1.53900 1.000 H67 H -3.36700 0.75800 3.99700 1.000 H68 H -1.49000 1.69700 5.28500 1.000 H69 H 0.38800 2.77800 4.11400 1.000 H70 H 0.39100 2.91200 1.65500 1.000 H71 H 6.54000 -1.77700 0.39000 1.000