# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JKK' 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 3.78200 2.03300 -0.51200 1.000 C1 C 4.58500 0.90800 -0.54700 1.000 C2 C 2.50200 1.95300 0.00400 1.000 C3 C 2.82500 -0.37700 0.44800 1.000 C4 C -1.69000 0.23800 0.47300 1.000 C5 C -2.64000 -0.10600 -0.67600 1.000 C6 C 0.62600 0.66000 1.03900 1.000 C7 C 4.10700 -0.29800 -0.06700 1.000 C8 C 2.02100 0.74700 0.47800 1.000 N9 N -0.31600 0.33100 -0.03900 1.000 O10 O -4.80700 1.05900 0.35500 1.000 O11 O -5.17500 -0.56300 -1.26800 1.000 O12 O -4.47700 -1.35200 0.80400 1.000 S13 S -4.33700 -0.22100 -0.04500 1.000 Cl14 Cl 5.11400 -1.71100 -0.11200 1.000 H15 H 4.15700 2.97600 -0.88200 1.000 H16 H 5.58500 0.97100 -0.95000 1.000 H17 H 1.87700 2.83300 0.03600 1.000 H18 H 2.45000 -1.32000 0.81900 1.000 H19 H -1.98000 1.19300 0.91000 1.000 H20 H -1.74300 -0.54100 1.23300 1.000 H21 H -2.58700 0.67300 -1.43700 1.000 H22 H -2.35000 -1.06100 -1.11400 1.000 H23 H 0.58900 -0.11600 1.80400 1.000 H24 H 0.35200 1.61800 1.48100 1.000 H25 H -0.25500 1.00100 -0.79000 1.000 H26 H -6.11900 -0.65800 -1.08400 1.000