# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9EY' 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 4.46800 0.25400 0.03400 1.000 C1 C -0.52800 1.91600 -2.94100 1.000 C2 C 0.29600 2.11200 -1.66500 1.000 C3 C 2.38200 1.18200 -0.81600 1.000 C4 C -1.37000 0.64400 -2.83600 1.000 C5 C -2.69500 0.84200 -3.57500 1.000 C6 C -0.62800 2.13600 -0.47400 1.000 C7 C -1.50300 2.50100 1.50300 1.000 C8 C -7.87800 -1.46400 1.37100 1.000 C9 C -3.70700 1.25000 1.12300 1.000 Cl10 Cl 5.44100 -4.82400 -0.35000 1.000 C11 C 7.62000 -1.66200 0.76000 1.000 C12 C 7.22000 -2.95100 0.46000 1.000 C13 C 5.92900 -3.20000 0.02200 1.000 C14 C 5.02900 -2.16400 -0.11900 1.000 C15 C 5.42100 -0.85500 0.18100 1.000 C16 C 6.73100 -0.60800 0.62400 1.000 N17 N 7.13500 0.69600 0.92800 1.000 C18 C 7.78400 1.11700 2.03600 1.000 N19 N 7.97200 2.40400 1.91000 1.000 N20 N 7.48500 2.82600 0.79900 1.000 N21 N 6.95800 1.84900 0.14400 1.000 C22 C 3.33300 0.08000 -0.67500 1.000 O23 O 2.61400 2.25700 -0.29400 1.000 N24 N 1.24800 1.00800 -1.52400 1.000 N25 N -0.40100 2.73000 0.71600 1.000 C26 C -2.36600 1.77400 0.76100 1.000 N27 N -1.80000 1.56700 -0.45100 1.000 C28 C -4.27300 1.44300 2.37200 1.000 C29 C -5.52500 0.92300 2.64200 1.000 C30 C -6.21300 0.21000 1.66700 1.000 C31 C -5.65000 0.01600 0.41000 1.000 C32 C -4.40200 0.53300 0.13700 1.000 N33 N -7.48000 -0.31400 1.95100 1.000 O34 O -7.10600 -2.09400 0.67800 1.000 O35 O -9.13300 -1.91300 1.56200 1.000 C36 C -9.49300 -3.15800 0.90700 1.000 C37 C -3.57800 -0.39800 -3.41800 1.000 C38 C -4.35200 -0.29300 -2.12100 1.000 N39 N -3.77600 0.37800 -1.10400 1.000 O40 O -5.45000 -0.79400 -2.00200 1.000 H41 H 4.67400 1.20800 0.49800 1.000 H42 H -1.18500 2.77400 -3.08100 1.000 H43 H 0.14400 1.83600 -3.79500 1.000 H44 H 0.83800 3.05600 -1.72400 1.000 H45 H -0.82700 -0.18900 -3.28300 1.000 H46 H -1.56900 0.42600 -1.78700 1.000 H47 H -3.21300 1.70800 -3.16300 1.000 H48 H -2.49700 1.01200 -4.63400 1.000 H49 H -1.65000 2.83800 2.51900 1.000 H50 H 8.62700 -1.47700 1.10400 1.000 H51 H 7.91800 -3.76800 0.56700 1.000 H52 H 4.02400 -2.36200 -0.46100 1.000 H53 H 8.09100 0.50300 2.87000 1.000 H54 H 3.12700 -0.87400 -1.13800 1.000 H55 H 1.06300 0.15200 -1.94000 1.000 H56 H 0.39300 3.22600 0.96900 1.000 H57 H -3.74000 1.99600 3.13100 1.000 H58 H -5.97000 1.07000 3.61500 1.000 H59 H -6.18600 -0.53700 -0.34600 1.000 H60 H -8.07000 0.15100 2.56400 1.000 H61 H -10.52900 -3.40600 1.14300 1.000 H62 H -9.38300 -3.04700 -0.17100 1.000 H63 H -8.84000 -3.95600 1.26000 1.000 H64 H -4.27400 -0.45900 -4.25400 1.000 H65 H -2.95200 -1.29100 -3.39900 1.000 H66 H -2.89700 0.76700 -1.23700 1.000