# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net
data_I
_chemical_name_common '9E1'
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    -5.85100   0.96100   0.31600   1.000
    C1      C    -5.78200  -1.16200   0.34800   1.000
    N2      N    -6.55300  -0.11000   0.43300   1.000
    C3      C    -3.70800   2.94800  -0.14300   1.000
    C4      C    -3.45800   1.58200  -0.02500   1.000
    C5      C    -1.36000   3.29800  -0.34300   1.000
    C6      C    2.75500   0.34500  -0.08600   1.000
    C7      C    -2.64300   3.81900  -0.30500   1.000
    N8      N    0.10900   1.39300  -0.25700   1.000
    C9      C    1.04400  -4.13000  -0.23100   1.000
    C10     C    3.12300  -2.41000  -0.08000   1.000
    C11     C    -3.04200  -2.30000   1.31900   1.000
    C12     C    -3.31000  -1.54600   0.01500   1.000
    C13     C    -3.51500  -2.54900  -1.12100   1.000
    N14     N    -4.51400  -0.72500   0.16500   1.000
    C15     C    -4.58700   0.64200   0.14800   1.000
    C16     C    -1.17900   1.92400  -0.22000   1.000
    N17     N    -2.21400   1.11700  -0.06600   1.000
    C18     C    0.28800   0.05800  -0.25400   1.000
    O19     O    -0.67300  -0.68400  -0.32400   1.000
    C20     C    1.64900  -0.50400  -0.16600   1.000
    C21     C    4.02400  -0.18700  -0.00500   1.000
    C22     C    4.20800  -1.55900  -0.00200   1.000
    C23     C    1.83900  -1.89300  -0.16300   1.000
    O24     O    0.77200  -2.72700  -0.24000   1.000
    S25     S    5.41900   0.88500   0.09600   1.000
    O26     O    6.53200   0.14100  -0.38000   1.000
    O27     O    5.01400   2.12500  -0.46900   1.000
    N28     N    5.70100   1.17300   1.70200   1.000
    H29     H    -6.09900  -2.19200   0.41200   1.000
    H30     H    -4.72100   3.32200  -0.11300   1.000
    H31     H    -0.51000   3.95200  -0.46800   1.000
    H32     H    2.61700   1.41600  -0.09300   1.000
    H33     H    -2.80900   4.88200  -0.39900   1.000
    H34     H    0.87700   1.98500  -0.28600   1.000
    H35     H    1.67600  -4.38400  -1.08200   1.000
    H36     H    1.55700  -4.39500   0.69400   1.000
    H37     H    0.10600  -4.68200  -0.29700   1.000
    H38     H    3.27500  -3.47900  -0.07800   1.000
    H39     H    -2.89600  -1.58500   2.12900   1.000
    H40     H    -3.89300  -2.94100   1.55000   1.000
    H41     H    -2.14700  -2.91100   1.20800   1.000
    H42     H    -2.45900  -0.90500  -0.21500   1.000
    H43     H    -4.36600  -3.19000  -0.89100   1.000
    H44     H    -3.70600  -2.01200  -2.05000   1.000
    H45     H    -2.61900  -3.16100  -1.23200   1.000
    H46     H    5.20600  -1.96700   0.06200   1.000
    H47     H    4.96400   1.16700   2.33200   1.000
    H48     H    6.60400   1.34900   2.01200   1.000