# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common 'C1I'
loop_
    _atom_site_type_symbol
    _atom_site_label
    _atom_site_Cartn_x
    _atom_site_Cartn_y
    _atom_site_Cartn_z
      C    C1     6.79500   -1.59800    1.05700
      N    N2     6.57300   -1.46200   -0.38800
      C    C3     6.45000   -2.77800   -1.02900
      C    C4     5.39300   -0.63000   -0.66300
      C    C5     4.21000   -1.13700    0.15500
      C    C6     2.96400   -0.31100   -0.08000
      C    C7     2.16900   -0.85900   -1.28700
      C    C8     0.69000   -0.65800   -0.87000
      C    C9     0.80200   -0.01700    0.52200
      O    O10     2.06300   -0.47200    1.04600
      C    C11     0.90700    1.48900    0.36700
      C    C12     2.21800    2.02400   -0.05700
      C    C13     3.21500    1.15300   -0.28200
      C    C14     4.53300    1.69600   -0.75900
      O    O15     4.70400    3.02400   -0.25900
      C    C16     5.68400    0.82100   -0.26700
      O    O17     6.90500    1.24800   -0.87400
      C    C18    -0.11200    2.29100    0.59500
      C    C19    -1.49100    1.83800    0.98900
      C    C20    -1.61700    0.34400    0.81800
      C    C21    -1.72300    0.00600   -0.67000
      C    C22    -2.76000   -0.32700    1.57700
      C    C23    -2.24100   -1.73800    1.94400
      C    C24    -0.77400   -1.81100    1.44300
      C    C25    -0.35900   -0.34000    1.41600
      C    C26    -3.97800   -0.43200    0.69700
      C    C27    -5.03800    0.39400    0.91900
      C    C28    -6.17400    0.29800    0.10000
      C    C29    -7.29600    1.12300    0.28100
      N    N30    -8.33500    0.99600   -0.51100
      C    C31    -8.38300    0.11000   -1.49600
      C    C32    -7.34700   -0.73600   -1.75400
      C    C33    -6.19700   -0.66000   -0.94700
      C    C34    -5.08800   -1.49400   -1.14600
      C    C35    -4.00000   -1.36800   -0.33500
      H    H36     7.75500   -2.08400    1.23300
      H    H37     6.79800   -0.61100    1.51900
      H    H38     5.99800   -2.20100    1.49200
      H    H39     5.60800   -3.31600   -0.59500
      H    H40     6.28600   -2.64700   -2.09900
      H    H41     7.36600   -3.34700   -0.86900
      H    H42     5.15100   -0.68000   -1.72500
      H    H43     4.00600   -2.17200   -0.11900
      H    H44     4.46800   -1.09600    1.21300
      H    H45     5.76400    0.89600    0.81700
      H    H46     2.39600   -0.28700   -2.18700
      H    H47     2.38400   -1.91700   -1.43900
      H    H48     0.18300    0.01400   -1.56400
      H    H49     0.17200   -1.61500   -0.81300
      H    H50    -0.17200    0.03700    2.42100
      H    H51     2.37000    3.08600   -0.18200
      H    H52     0.05500    3.35300    0.49200
      H    H53     4.54000    1.71900   -1.84900
      H    H54     5.53500    3.44100   -0.52600
      H    H55     7.15000    2.16000   -0.66500
      H    H56    -1.67300    2.09900    2.03200
      H    H57    -2.22900    2.33700    0.36000
      H    H58    -1.08000    0.67600   -1.24100
      H    H59    -1.40800   -1.02500   -0.83200
      H    H60    -2.75600    0.12600   -0.99700
      H    H61    -2.99400    0.23600    2.48100
      H    H62    -2.27500   -1.88000    3.02400
      H    H63    -2.84400   -2.49900    1.44700
      H    H64    -0.15500   -2.36800    2.14600
      H    H65    -0.72900   -2.25800    0.45000
      H    H66    -5.00500    1.11800    1.72000
      H    H67    -3.14400   -2.00800   -0.49100
      H    H68    -7.30400    1.86000    1.07000
      H    H69    -9.26900    0.05700   -2.11200
      H    H70    -7.40700   -1.45100   -2.56100
      H    H71    -5.09300   -2.22700   -1.93900