# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net
data_I
_chemical_name_common '967'
loop_
    _atom_site_label
    _atom_site_type_symbol
    _atom_site_fract_x
    _atom_site_fract_y
    _atom_site_fract_z
    _atom_site_occupancy
    N0      N    1.43800   1.81300  -0.76700   1.000
    C1      C    -1.97800   0.68900  -0.49700   1.000
    C2      C    0.30700   1.28000  -0.26400   1.000
    C3      C    3.28100  -0.07600   1.88900   1.000
    C4      C    3.78000  -0.61000  -0.33100   1.000
    C5      C    -3.28000  -0.30000   1.01900   1.000
    C6      C    4.62200  -2.86900  -0.52000   1.000
    C7      C    4.39500  -1.50800  -2.47800   1.000
    C8      C    4.74900  -2.70900  -1.88000   1.000
    C9      C    -4.20500  -0.20100   0.06100   1.000
    C10     C    4.13500  -1.82100   0.26800   1.000
    C11     C    3.92100  -0.47500  -1.72900   1.000
    C12     C    3.29800   0.35500   0.64400   1.000
    N13     N    -2.09600   0.18500   0.69100   1.000
    N14     N    -0.81100   1.23900  -1.01600   1.000
    O15     O    3.80000   2.51400  -0.63000   1.000
    O16     O    2.33400   2.60200   1.39300   1.000
    O17     O    0.29500   0.83600   0.86700   1.000
    S18     S    2.77600   1.97700   0.19500   1.000
    S19     S    3.86600  -1.72500   2.00400   1.000
    S20     S    -3.46300   0.57200  -1.33700   1.000
    Br21    Br   -5.99700  -0.79000   0.18400   1.000
    H22     H    1.47000   2.09600  -1.69500   1.000
    H23     H    2.95300   0.51300   2.73300   1.000
    H24     H    -3.48300  -0.74100   1.98400   1.000
    H25     H    4.89700  -3.80600  -0.05900   1.000
    H26     H    4.49900  -1.39100  -3.54600   1.000
    H27     H    5.12400  -3.52200  -2.48400   1.000
    H28     H    3.65000   0.45500  -2.20800   1.000
    H29     H    -0.80100   1.59300  -1.91900   1.000