COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.478   2.386   0.400  1.00  0.00           C  
HETATM    2  I   UNL     1      -3.454   0.775  -0.103  1.00  0.00           I  
HETATM    3  N   UNL     1      -0.899   2.412   0.480  1.00  0.00           N  
HETATM    4  O   UNL     1      -0.609  -4.261   1.554  1.00  0.00           O  
HETATM    5  C   UNL     1       1.472   3.296   0.747  1.00  0.00           C  
HETATM    6  N   UNL     1      -0.697  -3.320  -0.454  1.00  0.00           N  
HETATM    7  O   UNL     1       6.214  -0.135  -0.387  1.00  0.00           O  
HETATM    8  C   UNL     1       2.796   2.980   0.543  1.00  0.00           C  
HETATM    9  N   UNL     1       4.509   1.448  -0.214  1.00  0.00           N  
HETATM   10  O   UNL     1       4.175  -0.688   0.291  1.00  0.00           O  
HETATM   11  C   UNL     1       3.156   1.753  -0.012  1.00  0.00           C  
HETATM   12  C   UNL     1       2.183   0.836  -0.363  1.00  0.00           C  
HETATM   13  C   UNL     1       0.837   1.150  -0.166  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.419   0.438  -0.415  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.414   1.242  -0.005  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.566  -0.941  -1.004  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.554  -1.980   0.119  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.713  -4.400   0.353  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.859  -5.779  -0.236  1.00  0.00           C  
HETATM   20  C   UNL     1       4.939   0.177  -0.090  1.00  0.00           C  
HETATM   21  C   UNL     1       6.608  -1.524  -0.230  1.00  0.00           C  
HETATM   22  H   UNL     1       1.204   4.250   1.177  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.780  -3.431  -1.414  1.00  0.00           H  
HETATM   24  H   UNL     1       3.563   3.690   0.814  1.00  0.00           H  
HETATM   25  H   UNL     1       5.136   2.152  -0.443  1.00  0.00           H  
HETATM   26  H   UNL     1       2.463  -0.114  -0.793  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.508  -1.005  -1.548  1.00  0.00           H  
HETATM   28  H   UNL     1       0.261  -1.135  -1.687  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.382  -1.786   0.802  1.00  0.00           H  
HETATM   30  H   UNL     1       0.388  -1.915   0.663  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.917  -6.037  -0.298  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.422  -5.796  -1.234  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.346  -6.502   0.398  1.00  0.00           H  
HETATM   34  H   UNL     1       6.467  -1.826   0.808  1.00  0.00           H  
HETATM   35  H   UNL     1       5.994  -2.151  -0.877  1.00  0.00           H  
HETATM   36  H   UNL     1       7.657  -1.638  -0.502  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.423   3.150   0.829  1.00  0.00           H  
CONECT    1   13   13    3    5                                       
CONECT    2   15                                                      
CONECT    3    1   15   37                                            
CONECT    4   18   18                                                 
CONECT    5    1    8    8   22                                       
CONECT    6   18   17   23                                            
CONECT    7   20   21                                                 
CONECT    8    5    5   11   24                                       
CONECT    9   20   11   25                                            
CONECT   10   20   20                                                 
CONECT   11    8    9   12   12                                       
CONECT   12   11   11   13   26                                       
CONECT   13    1    1   12   14                                       
CONECT   14   13   16   15   15                                       
CONECT   15    2    3   14   14                                       
CONECT   16   14   17   27   28                                       
CONECT   17    6   16   29   30                                       
CONECT   18    4    4    6   19                                       
CONECT   19   18   31   32   33                                       
CONECT   20    7    9   10   10                                       
CONECT   21    7   34   35   36                                       
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26   12                                                      
CONECT   27   16                                                      
CONECT   28   16                                                      
CONECT   29   17                                                      
CONECT   30   17                                                      
CONECT   31   19                                                      
CONECT   32   19                                                      
CONECT   33   19                                                      
CONECT   34   21                                                      
CONECT   35   21                                                      
CONECT   36   21                                                      
CONECT   37    3                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
