# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JI7' 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 7.43000 1.24700 -0.25600 1.000 C1 C 6.46400 2.22600 -0.11000 1.000 C2 C 5.18300 1.84200 0.26200 1.000 C3 C 4.91200 0.50500 0.47500 1.000 N4 N 5.85400 -0.40700 0.33000 1.000 C5 C 7.08600 -0.08200 -0.03000 1.000 C6 C 3.52300 0.08300 0.88000 1.000 C7 C 3.00500 -0.97100 -0.10100 1.000 C8 C 1.55900 -1.37900 0.26500 1.000 C9 C 1.55500 -2.90700 0.00800 1.000 N10 N 2.90500 -3.33200 0.46000 1.000 C11 C 3.83100 -2.26600 0.02100 1.000 N12 N 0.59200 -0.70200 -0.60900 1.000 C13 C -0.71800 -0.58600 0.04600 1.000 C14 C -1.69700 0.12300 -0.89200 1.000 N15 N -3.00600 0.23900 -0.23700 1.000 C16 C -3.97400 0.91600 -1.11000 1.000 C17 C -5.30200 1.01700 -0.40600 1.000 C18 C -5.58700 2.12000 0.37700 1.000 C19 C -6.80500 2.21300 1.02400 1.000 C20 C -7.73900 1.20300 0.88800 1.000 C21 C -7.45500 0.09900 0.10500 1.000 C22 C -6.23700 0.00900 -0.54700 1.000 Cl23 Cl -8.62700 -1.17000 -0.06600 1.000 C24 C 6.79500 3.67600 -0.35000 1.000 N25 N 8.04700 -1.07600 -0.17200 1.000 H26 H 8.43700 1.51000 -0.54500 1.000 H27 H 4.40600 2.58200 0.38400 1.000 H28 H 3.55000 -0.33800 1.88500 1.000 H29 H 2.86100 0.94900 0.86500 1.000 H30 H 3.04600 -0.59100 -1.12100 1.000 H31 H 1.35000 -1.16100 1.31200 1.000 H32 H 0.78000 -3.39500 0.60000 1.000 H33 H 1.42000 -3.11800 -1.05300 1.000 H34 H 2.93200 -3.44400 1.46200 1.000 H35 H 4.26100 -2.52300 -0.94700 1.000 H36 H 4.62200 -2.13300 0.75800 1.000 H37 H 0.93400 0.20200 -0.89600 1.000 H38 H -1.09600 -1.58100 0.28200 1.000 H39 H -0.61400 -0.00900 0.96600 1.000 H40 H -1.31900 1.11700 -1.12800 1.000 H41 H -1.80100 -0.45400 -1.81100 1.000 H42 H -2.92600 0.71400 0.65000 1.000 H43 H -3.61200 1.91600 -1.34800 1.000 H44 H -4.09400 0.34500 -2.03100 1.000 H45 H -4.85800 2.90900 0.48400 1.000 H46 H -7.02700 3.07500 1.63500 1.000 H47 H -8.69100 1.27600 1.39300 1.000 H48 H -6.01500 -0.85300 -1.15900 1.000 H49 H 6.61900 3.92100 -1.39800 1.000 H50 H 6.16300 4.30200 0.28000 1.000 H51 H 7.84200 3.85500 -0.10700 1.000 H52 H 7.81400 -2.00300 -0.00700 1.000 H53 H 8.95100 -0.84300 -0.43500 1.000