# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net
data_I
_chemical_name_common 'JUG'
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    -2.81500  -1.35000   0.00800   1.000
    C1      C    -1.98100  -0.46700   0.00300   1.000
    C2      C    -2.40000   0.94700   0.00600   1.000
    C3      C    -1.49200   1.93300   0.00100   1.000
    C4      C    -0.04800   1.63300  -0.00800   1.000
    O5      O    0.76200   2.53900  -0.01200   1.000
    C6      C    0.41000   0.23200  -0.01100   1.000
    C7      C    -0.54200  -0.80500   0.00000   1.000
    C8      C    -0.12100  -2.12900   0.00200   1.000
    C9      C    1.23600  -2.42400  -0.00100   1.000
    C10     C    2.17400  -1.41400  -0.00600   1.000
    C11     C    1.77100  -0.07800  -0.02000   1.000
    O12     O    2.69600   0.91200  -0.02500   1.000
    H13     H    -3.45200   1.19100   0.01200   1.000
    H14     H    -1.82300   2.96100   0.00300   1.000
    H15     H    -0.84800  -2.92700   0.00600   1.000
    H16     H    1.55900  -3.45500   0.00000   1.000
    H17     H    3.22600  -1.65800  -0.00800   1.000
    H18     H    2.97000   1.20000   0.85700   1.000