COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.178  -0.956  -1.507  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.059   1.138   0.754  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.909   0.058   0.136  1.00  0.00           C  
HETATM    4  C   UNL     1       2.625   1.313  -1.217  1.00  0.00           C  
HETATM    5  C   UNL     1       0.398   1.985  -0.997  1.00  0.00           C  
HETATM    6  C   UNL     1       2.470   0.470  -0.090  1.00  0.00           C  
HETATM    7  C   UNL     1       1.275   0.424   0.536  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.380   1.844   1.165  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.678   0.628   1.712  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.978  -1.222   0.002  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.245  -2.581   0.049  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.089  -2.976  -1.436  1.00  0.00           C  
HETATM   13  O   UNL     1      -3.144  -1.726  -2.158  1.00  0.00           O  
HETATM   14  N   UNL     1      -3.152  -0.172   0.603  1.00  0.00           N  
HETATM   15  N   UNL     1      -4.053  -3.578   0.765  1.00  0.00           N  
HETATM   16  N   UNL     1       0.238   1.188   0.075  1.00  0.00           N  
HETATM   17  N   UNL     1       1.579   2.051  -1.640  1.00  0.00           N  
HETATM   18  O   UNL     1      -4.436   2.024  -0.029  1.00  0.00           O  
HETATM   19  O   UNL     1       3.695   1.376  -1.796  1.00  0.00           O  
HETATM   20  O   UNL     1      -0.537   2.656  -1.391  1.00  0.00           O  
HETATM   21  O   UNL     1      -1.474  -0.605  -0.782  1.00  0.00           O  
HETATM   22  I   UNL     1       4.074  -0.691   0.595  1.00  0.00           I  
HETATM   23  H   UNL     1      -5.163  -1.299  -1.825  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.056   0.105  -1.724  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.562   2.099   0.650  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.907   0.920   1.811  1.00  0.00           H  
HETATM   27  H   UNL     1       1.138  -0.214   1.398  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.383   3.492   1.605  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.855   0.942   2.355  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.383   0.031   2.289  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.940  -1.290   0.509  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.268  -2.472   0.520  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.129  -3.466  -1.599  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.905  -3.630  -1.743  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.581  -4.469   0.800  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.287  -3.256   1.692  1.00  0.00           H  
HETATM   37  H   UNL     1       1.677   2.631  -2.412  1.00  0.00           H  
HETATM   38  O   UNL     1      -4.943   2.728   2.003  1.00  0.00           O  
CONECT    1   10   13   23   24                                       
CONECT    2   16    3   25   26                                       
CONECT    3    2   21   21   14                                       
CONECT    4   19   19   17    6                                       
CONECT    5   17   20   20   16                                       
CONECT    6    4    7    7   22                                       
CONECT    7    6    6   16   27                                       
CONECT    8   18   18    9   38                                       
CONECT    9    8   14   29   30                                       
CONECT   10   14    1   11   31                                       
CONECT   11   10   12   15   32                                       
CONECT   12   13   11   33   34                                       
CONECT   13    1   12                                                 
CONECT   14    3    9   10                                            
CONECT   15   11   35   36                                            
CONECT   16    5    7    2                                            
CONECT   17    4    5   37                                            
CONECT   18    8    8                                                 
CONECT   19    4    4                                                 
CONECT   20    5    5                                                 
CONECT   21    3    3                                                 
CONECT   22    6                                                      
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    7                                                      
CONECT   28   38                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
CONECT   37   17                                                      
CONECT   38    8   28                                                 
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
