# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net
data_I
_chemical_name_common '945'
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    -0.75800  -1.11500   0.64100   1.000
    C1      C    -1.70100  -0.79700  -0.52100   1.000
    C2      C    -1.22700   1.64000  -0.23900   1.000
    C3      C    0.34500  -0.05600   0.70700   1.000
    C4      C    -0.28400   1.32100   0.92300   1.000
    C5      C    -2.33000   0.58100  -0.30500   1.000
    C6      C    -0.12900  -2.49300   0.42500   1.000
    O7      O    -1.14700  -3.49500   0.47900   1.000
    O8      O    1.08100  -0.05800  -0.51800   1.000
    O9      O    -1.81400   2.92700  -0.03700   1.000
    O10     O    -3.21100   0.87800  -1.39000   1.000
    O11     O    -2.73100  -1.78600  -0.58300   1.000
    S12     S    2.56400   0.23700  -0.34900   1.000
    O13     O    3.21000  -1.01600   0.22700   1.000
    O14     O    3.09400   0.39500  -1.65800   1.000
    O15     O    2.66300   1.23700   0.65500   1.000
    H16     H    -1.31900  -1.11500   1.57500   1.000
    H17     H    -1.14000  -0.79800  -1.45600   1.000
    H18     H    -0.66600   1.63900  -1.17300   1.000
    H19     H    1.01700  -0.28300   1.53500   1.000
    H20     H    0.50200   2.07600   0.97000   1.000
    H21     H    -2.89100   0.58200   0.62900   1.000
    H22     H    0.35700  -2.52200  -0.55000   1.000
    H23     H    0.60900  -2.68200   1.20400   1.000
    H24     H    -0.81900  -4.39600   0.35000   1.000
    H25     H    -2.42500   3.19400  -0.73700   1.000
    H26     H    -3.64600   1.73800  -1.32000   1.000
    H27     H    -3.36700  -1.64800  -1.29800   1.000
    O28     O    -1.02000   1.32300   2.14800   1.000
    H29     H    4.16200  -0.93500   0.37500   1.000
    H30     H    -1.44600   2.16700   2.35000   1.000