# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JJZ' 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 -8.73400 1.11000 -0.55700 1.000 C1 C -7.64300 1.67400 -1.19100 1.000 C2 C -6.39200 1.10700 -1.05200 1.000 O3 O -3.97700 1.38000 -0.14700 1.000 O4 O 0.05500 -1.19100 -0.03800 1.000 Cl5 Cl -9.94800 -0.73100 1.01500 1.000 C6 C -8.57600 -0.02500 0.22000 1.000 C7 C -7.32600 -0.59600 0.36400 1.000 C8 C -6.22900 -0.03100 -0.27300 1.000 N9 N -4.96200 -0.60800 -0.13100 1.000 C10 C -3.86300 0.17300 -0.12500 1.000 C11 C -2.49300 -0.45500 -0.09300 1.000 C12 C -1.42900 0.64400 -0.09300 1.000 C13 C -0.05900 0.01700 -0.06000 1.000 N14 N 1.04000 0.79700 -0.05400 1.000 N15 N 2.31300 0.21400 -0.02400 1.000 C16 C 3.37500 0.96800 -0.01900 1.000 C17 C 3.90800 -3.22700 -0.30100 1.000 C18 C 3.73300 -1.88200 -0.21100 1.000 C19 C 4.85300 -1.04200 -0.08300 1.000 C20 C 4.70700 0.35700 0.01400 1.000 C21 C 5.85700 1.16300 0.14100 1.000 C22 C 5.75700 2.56100 0.24100 1.000 C23 C 6.88600 3.30900 0.36300 1.000 C24 C 5.17700 -3.80300 -0.27100 1.000 C25 C 6.30000 -3.04800 -0.14900 1.000 C26 C 6.18700 -1.64400 -0.05100 1.000 C27 C 7.32000 -0.84000 0.07500 1.000 C28 C 7.18500 0.54500 0.17200 1.000 C29 C 8.31700 1.37900 0.30000 1.000 C30 C 8.15100 2.72400 0.39200 1.000 H31 H -9.71100 1.55800 -0.66400 1.000 H32 H -7.77000 2.55900 -1.79600 1.000 H33 H -5.54000 1.54800 -1.54800 1.000 H34 H -7.20200 -1.48200 0.97000 1.000 H35 H -4.87400 -1.56900 -0.03600 1.000 H36 H -2.39200 -1.05900 0.80900 1.000 H37 H -2.36200 -1.08800 -0.97000 1.000 H38 H -1.53000 1.24800 -0.99500 1.000 H39 H -1.56000 1.27700 0.78500 1.000 H40 H 0.94900 1.76300 -0.07200 1.000 H41 H 3.27300 2.04300 -0.03800 1.000 H42 H 3.04300 -3.86600 -0.39400 1.000 H43 H 2.73800 -1.46100 -0.23700 1.000 H44 H 4.78900 3.03900 0.22000 1.000 H45 H 6.80100 4.38300 0.43900 1.000 H46 H 5.27000 -4.87600 -0.34500 1.000 H47 H 7.27200 -3.51800 -0.12800 1.000 H48 H 8.30200 -1.29000 0.09900 1.000 H49 H 9.30800 0.95000 0.32600 1.000 H50 H 9.02100 3.35600 0.49000 1.000