# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CHJ' 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 -0.61100 0.13500 -1.56700 1.000 C1 C -0.35900 -0.86700 -0.63100 1.000 O2 O 0.84000 -1.50300 -0.63300 1.000 C3 C 1.94300 -0.78800 -0.28300 1.000 C4 C 3.20800 -1.35600 -0.39900 1.000 O5 O 3.34500 -2.62700 -0.86300 1.000 C6 C 4.32900 -0.62400 -0.04200 1.000 C7 C 4.18800 0.67000 0.42900 1.000 Cl8 Cl 5.59300 1.58600 0.87700 1.000 C9 C 2.93000 1.23400 0.54400 1.000 C10 C 1.80900 0.51000 0.18400 1.000 C11 C -1.32200 -1.21900 0.30100 1.000 C12 C -2.54700 -0.56900 0.30300 1.000 C13 C -2.79600 0.44100 -0.64400 1.000 C14 C -1.80900 0.78700 -1.57500 1.000 C15 C -4.09300 1.12000 -0.63200 1.000 C16 C -4.40600 2.20800 -1.62700 1.000 C17 C -5.00700 0.74300 0.29900 1.000 C18 C -4.69000 -0.27800 1.21900 1.000 O19 O -5.51900 -0.60700 2.04900 1.000 O20 O -3.50000 -0.89700 1.20300 1.000 H21 H 0.14900 0.39900 -2.28800 1.000 H22 H 3.44700 -2.68700 -1.82300 1.000 H23 H 5.31200 -1.06200 -0.13100 1.000 H24 H 2.82400 2.24400 0.91200 1.000 H25 H 0.82800 0.95400 0.27100 1.000 H26 H -1.11900 -1.99600 1.02200 1.000 H27 H -1.99900 1.56300 -2.30200 1.000 H28 H -4.85500 1.76800 -2.51800 1.000 H29 H -5.10200 2.91800 -1.18200 1.000 H30 H -3.48600 2.72500 -1.90100 1.000 H31 H -5.97300 1.22400 0.33600 1.000