COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.173   0.360  -0.084  1.00  0.00           C  
HETATM    2  C   UNL     1       5.275  -0.932  -0.613  1.00  0.00           C  
HETATM    3  C   UNL     1       4.164  -1.714  -0.750  1.00  0.00           C  
HETATM    4  C   UNL     1       2.919  -1.232  -0.363  1.00  0.00           C  
HETATM    5  C   UNL     1       2.798   0.065   0.171  1.00  0.00           C  
HETATM    6  C   UNL     1       3.937   0.858   0.314  1.00  0.00           C  
HETATM    7  C   UNL     1       6.384   1.195   0.059  1.00  0.00           C  
HETATM    8  N   UNL     1       6.290   2.425   0.562  1.00  0.00           N  
HETATM    9  N   UNL     1       7.570   0.718  -0.316  1.00  0.00           N1+
HETATM   10  N   UNL     1       1.646  -1.763  -0.375  1.00  0.00           N  
HETATM   11  N   UNL     1       1.486   0.260   0.454  1.00  0.00           N  
HETATM   12  C   UNL     1       0.803  -0.812   0.135  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.656  -0.970   0.300  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.184  -2.185   0.743  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.547  -2.329   0.896  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.398  -1.274   0.612  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.888  -0.064   0.172  1.00  0.00           C  
HETATM   18  O   UNL     1      -3.729   0.968  -0.105  1.00  0.00           O  
HETATM   19  C   UNL     1      -1.515   0.097   0.018  1.00  0.00           C  
HETATM   20  O   UNL     1      -1.011   1.283  -0.414  1.00  0.00           O1-
HETATM   21  C   UNL     1      -5.928   1.786   0.535  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.036   0.555   0.298  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.703  -0.262  -0.827  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.192   0.161  -0.773  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.106   1.674  -0.455  1.00  0.00           C  
HETATM   26  H   UNL     1       6.239  -1.313  -0.916  1.00  0.00           H  
HETATM   27  H   UNL     1       4.253  -2.709  -1.160  1.00  0.00           H  
HETATM   28  H   UNL     1       3.858   1.853   0.727  1.00  0.00           H  
HETATM   29  H   UNL     1       5.426   2.772   0.835  1.00  0.00           H  
HETATM   30  H   UNL     1       7.085   2.973   0.656  1.00  0.00           H  
HETATM   31  H   UNL     1       8.365   1.267  -0.223  1.00  0.00           H  
HETATM   32  H   UNL     1       7.640  -0.178  -0.679  1.00  0.00           H  
HETATM   33  H   UNL     1       1.395  -2.647  -0.687  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.526  -3.011   0.966  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.953  -3.270   1.239  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.464  -1.396   0.734  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.300   1.786   1.560  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.364   2.699   0.342  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.975  -0.042   1.208  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.269  -0.006  -1.794  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.603  -1.330  -0.634  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.716  -0.372   0.021  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.676  -0.005  -1.735  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.029   2.019   0.011  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.899   2.243  -1.361  1.00  0.00           H  
CONECT    1    2    2    6    7                                       
CONECT    2    1    1    3   26                                       
CONECT    3    2    4    4   27                                       
CONECT    4    3    3    5   10                                       
CONECT    5    4    6    6   11                                       
CONECT    6    1    5    5   28                                       
CONECT    7    1    8    9    9                                       
CONECT    8    7   29   30                                            
CONECT    9    7    7   31   32                                       
CONECT   10    4   12   33                                            
CONECT   11    5   12   12                                            
CONECT   12   10   11   11   13                                       
CONECT   13   12   14   14   19                                       
CONECT   14   13   13   15   34                                       
CONECT   15   14   16   16   35                                       
CONECT   16   15   15   17   36                                       
CONECT   17   16   18   19   19                                       
CONECT   18   17   22                                                 
CONECT   19   13   17   17   20                                       
CONECT   20   19                                                      
CONECT   21   22   25   37   38                                       
CONECT   22   18   21   23   39                                       
CONECT   23   22   24   40   41                                       
CONECT   24   23   25   42   43                                       
CONECT   25   21   24   44   45                                       
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    6                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   21                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
