# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JMS' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O -1.53600 -2.19600 2.25100 1.000 C1 C -1.07000 -1.66300 1.10400 1.000 O2 O 0.08700 -1.84400 0.77600 1.000 C3 C -1.96200 -0.86300 0.24800 1.000 C4 C -3.32000 -0.75300 0.55700 1.000 C5 C -4.14900 -0.00300 -0.24900 1.000 C6 C -3.64400 0.64300 -1.36600 1.000 C7 C -2.30500 0.54400 -1.68500 1.000 C8 C -1.45200 -0.20200 -0.88200 1.000 N9 N -0.10400 -0.30300 -1.20000 1.000 C10 C 0.85100 0.35800 -0.42100 1.000 C11 C 2.16600 -0.09200 -0.40000 1.000 Cl12 Cl 2.62600 -1.47700 -1.34100 1.000 C13 C 3.10600 0.56300 0.37200 1.000 C14 C 4.53200 0.07600 0.39600 1.000 C15 C 2.74100 1.66700 1.12100 1.000 C16 C 1.43400 2.11800 1.10200 1.000 C17 C 0.48900 1.47000 0.32900 1.000 Cl18 Cl -1.15200 2.03700 0.30600 1.000 H19 H -0.91300 -2.71300 2.78000 1.000 H20 H -3.72000 -1.25500 1.42500 1.000 H21 H -5.19900 0.08100 -0.00900 1.000 H22 H -4.30200 1.22800 -1.99000 1.000 H23 H -1.91900 1.05500 -2.55400 1.000 H24 H 0.17500 -0.83300 -1.96400 1.000 H25 H 5.09900 0.57200 -0.39200 1.000 H26 H 4.97800 0.30500 1.36400 1.000 H27 H 4.55100 -1.00200 0.23300 1.000 H28 H 3.47800 2.17700 1.72300 1.000 H29 H 1.15200 2.97900 1.68900 1.000