COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.288  -0.746  -0.590  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.728   0.315   0.186  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.519   1.602  -0.063  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.996   2.650   0.756  1.00  0.00           O  
HETATM    5  C   UNL     1      -4.991   1.363   0.288  1.00  0.00           C  
HETATM    6  O   UNL     1      -5.750   2.536  -0.011  1.00  0.00           O  
HETATM    7  C   UNL     1      -5.517   0.187  -0.540  1.00  0.00           C  
HETATM    8  O   UNL     1      -6.869  -0.092  -0.168  1.00  0.00           O  
HETATM    9  C   UNL     1      -4.649  -1.045  -0.272  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.132  -2.209  -1.140  1.00  0.00           C  
HETATM   11  O   UNL     1      -4.397  -3.388  -0.808  1.00  0.00           O  
HETATM   12  N   UNL     1      -1.330   0.518  -0.201  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.343  -0.080   0.495  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.613  -0.788   1.446  1.00  0.00           O  
HETATM   15  N   UNL     1       0.943   0.107   0.139  1.00  0.00           N  
HETATM   16  C   UNL     1       1.929  -0.491   0.835  1.00  0.00           C  
HETATM   17  O   UNL     1       1.659  -1.199   1.785  1.00  0.00           O  
HETATM   18  C   UNL     1       3.339  -0.287   0.444  1.00  0.00           C  
HETATM   19  C   UNL     1       4.364  -0.905   1.164  1.00  0.00           C  
HETATM   20  C   UNL     1       5.678  -0.709   0.793  1.00  0.00           C  
HETATM   21  C   UNL     1       5.982   0.098  -0.289  1.00  0.00           C  
HETATM   22  C   UNL     1       4.972   0.713  -1.007  1.00  0.00           C  
HETATM   23  C   UNL     1       3.653   0.521  -0.650  1.00  0.00           C  
HETATM   24  N   UNL     1       7.395   0.308  -0.677  1.00  0.00           N1+
HETATM   25  O   UNL     1       7.666   1.022  -1.626  1.00  0.00           O  
HETATM   26  O   UNL     1       8.287  -0.232  -0.047  1.00  0.00           O1-
HETATM   27  H   UNL     1      -2.778   0.057   1.244  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.436   1.882  -1.113  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.065   2.851   0.590  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.079   1.132   1.350  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.465   3.323   0.474  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.476   0.439  -1.599  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.475   0.649  -0.307  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.724  -1.321   0.780  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.194  -2.379  -0.962  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.974  -1.967  -2.192  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.651  -4.168  -1.321  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.114   1.083  -0.960  1.00  0.00           H  
HETATM   39  H   UNL     1       1.159   0.672  -0.620  1.00  0.00           H  
HETATM   40  H   UNL     1       4.128  -1.534   2.009  1.00  0.00           H  
HETATM   41  H   UNL     1       6.471  -1.187   1.349  1.00  0.00           H  
HETATM   42  H   UNL     1       5.216   1.342  -1.850  1.00  0.00           H  
HETATM   43  H   UNL     1       2.866   1.002  -1.212  1.00  0.00           H  
CONECT    1    2    9                                                 
CONECT    2   12    3    1   27                                       
CONECT    3    4    2    5   28                                       
CONECT    4    3   29                                                 
CONECT    5    3    6    7   30                                       
CONECT    6    5   31                                                 
CONECT    7    5    9    8   32                                       
CONECT    8    7   33                                                 
CONECT    9    1    7   10   34                                       
CONECT   10    9   11   35   36                                       
CONECT   11   10   37                                                 
CONECT   12   13    2   38                                            
CONECT   13   15   14   14   12                                       
CONECT   14   13   13                                                 
CONECT   15   16   13   39                                            
CONECT   16   18   15   17   17                                       
CONECT   17   16   16                                                 
CONECT   18   23   23   19   16                                       
CONECT   19   20   20   18   40                                       
CONECT   20   21   19   19   41                                       
CONECT   21   24   22   22   20                                       
CONECT   22   21   21   23   42                                       
CONECT   23   22   18   18   43                                       
CONECT   24   25   25   26   21                                       
CONECT   25   24   24                                                 
CONECT   26   24                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   15                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
