# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JHM' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy S0 S -3.08400 -0.04100 -0.05800 1.000 C1 C 2.23700 1.79700 0.32100 1.000 O2 O 2.34900 2.13500 -1.06300 1.000 C3 C 3.34900 0.81500 0.69800 1.000 C4 C 3.17700 -0.47500 -0.11000 1.000 O5 O 4.16900 -1.42400 0.28700 1.000 C6 C 1.78100 -1.04700 0.15400 1.000 O7 O 1.58300 -2.21100 -0.65000 1.000 C8 C 0.73000 0.00700 -0.20200 1.000 O9 O 0.96600 1.19100 0.56200 1.000 C10 C -0.66500 -0.53600 0.11500 1.000 O11 O -1.65200 0.39900 -0.32500 1.000 O12 O -3.12600 -1.44000 -0.30300 1.000 O13 O -3.34200 0.14200 1.43100 1.000 O14 O -3.92100 0.89200 -0.72800 1.000 H15 H 2.33000 2.70000 0.92400 1.000 H16 H 1.67500 2.75500 -1.37300 1.000 H17 H 4.31900 1.25900 0.47400 1.000 H18 H 3.28900 0.58800 1.76300 1.000 H19 H 3.28700 -0.25600 -1.17200 1.000 H20 H 5.07800 -1.12300 0.15300 1.000 H21 H 1.69000 -1.31200 1.20800 1.000 H22 H 2.21800 -2.92000 -0.48100 1.000 H23 H 0.79600 0.24100 -1.26500 1.000 H24 H -0.81000 -1.48700 -0.39900 1.000 H25 H -0.76000 -0.68600 1.19100 1.000 H26 H -4.23200 -0.11100 1.71000 1.000