# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JE4' 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 0.36900 -0.05300 -0.55800 1.000 C1 C -0.48800 -1.11800 -0.87700 1.000 C2 C -2.31900 0.18000 -0.32200 1.000 O3 O 0.52000 2.11300 0.17600 1.000 C4 C -7.00900 0.80500 -0.05200 1.000 C5 C 1.73000 -0.52700 -0.80000 1.000 C6 C 2.97900 0.24700 -0.60400 1.000 C7 C 4.04400 -0.31000 0.10400 1.000 C8 C 5.20600 0.41800 0.28400 1.000 C9 C 5.31200 1.69600 -0.23700 1.000 C10 C 4.25800 2.25200 -0.94000 1.000 C11 C 3.09500 1.53300 -1.13100 1.000 C12 C -4.57200 -0.29400 -1.21100 1.000 C13 C -0.19100 1.16600 -0.11000 1.000 C14 C -2.15500 2.49500 0.46000 1.000 C15 C -4.27500 1.01100 0.93400 1.000 C16 C -5.29200 0.09200 1.61800 1.000 C17 C -6.30800 -0.39800 0.58200 1.000 C18 C -5.58600 -1.19900 -0.50400 1.000 N19 N -1.81200 -0.95500 -0.74400 1.000 N20 N -1.53600 1.25200 -0.00700 1.000 N21 N -3.68100 0.29600 -0.20300 1.000 N22 N -7.30400 -1.25300 1.24100 1.000 N23 N 0.29800 -2.15200 -1.28000 1.000 N24 N 1.64100 -1.76700 -1.22400 1.000 Cl25 Cl 6.53300 -0.27200 1.16400 1.000 Cl26 Cl 3.91100 -1.91200 0.75800 1.000 H27 H -6.27000 1.44100 -0.54000 1.000 H28 H -7.73200 0.45700 -0.78900 1.000 H29 H -7.52400 1.37500 0.72100 1.000 H30 H 6.22000 2.26100 -0.09400 1.000 H31 H 4.34600 3.25000 -1.34300 1.000 H32 H 2.27400 1.96900 -1.68000 1.000 H33 H -3.98700 -0.88300 -1.91700 1.000 H34 H -5.09700 0.50000 -1.74400 1.000 H35 H -2.26200 2.46300 1.54400 1.000 H36 H -1.52500 3.34100 0.18200 1.000 H37 H -3.13700 2.60800 0.00100 1.000 H38 H -4.77700 1.91100 0.57800 1.000 H39 H -3.49400 1.28300 1.64400 1.000 H40 H -4.77500 -0.76400 2.05200 1.000 H41 H -5.81000 0.64200 2.40400 1.000 H42 H -6.31300 -1.56600 -1.22800 1.000 H43 H -5.06600 -2.04200 -0.04900 1.000 H44 H -7.98700 -1.58900 0.57800 1.000 H45 H -6.86000 -2.02100 1.72200 1.000 H46 H -0.02400 -3.02200 -1.56200 1.000