COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.669  -2.390  -0.074  1.00  0.00           C  
HETATM    2  N   UNL     1       5.787  -3.755  -0.097  1.00  0.00           N  
HETATM    3  O   UNL     1       7.744   0.396  -0.062  1.00  0.00           O  
HETATM    4  C   UNL     1       6.738  -0.288  -0.057  1.00  0.00           C  
HETATM    5  N   UNL     1       6.807  -1.639  -0.079  1.00  0.00           N  
HETATM    6  O   UNL     1       1.390   3.093   0.081  1.00  0.00           O  
HETATM    7  C   UNL     1       5.396   0.324  -0.027  1.00  0.00           C  
HETATM    8  N   UNL     1       4.467  -1.869  -0.052  1.00  0.00           N  
HETATM    9  O   UNL     1      -4.212  -0.905   0.079  1.00  0.00           O  
HETATM   10  C   UNL     1       4.272  -0.537  -0.029  1.00  0.00           C  
HETATM   11  N   UNL     1       3.047  -0.015  -0.002  1.00  0.00           N  
HETATM   12  C   UNL     1       2.897   1.302   0.026  1.00  0.00           C  
HETATM   13  N   UNL     1       5.231   1.639   0.000  1.00  0.00           N  
HETATM   14  C   UNL     1       4.014   2.145   0.027  1.00  0.00           C  
HETATM   15  N   UNL     1       0.454   1.079   0.054  1.00  0.00           N  
HETATM   16  C   UNL     1       1.533   1.887   0.056  1.00  0.00           C  
HETATM   17  N   UNL     1      -3.276   1.109   0.106  1.00  0.00           N  
HETATM   18  C   UNL     1      -0.893   1.657   0.084  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.594   0.833   0.132  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.930   0.532   0.076  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.356   0.302   0.104  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.714   0.001   0.033  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.695  -1.263   0.608  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.803  -2.082   0.510  1.00  0.00           C  
HETATM   25  C   UNL     1      -8.930  -1.645  -0.162  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.952  -0.387  -0.736  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.850   0.438  -0.636  1.00  0.00           C  
HETATM   28  H   UNL     1       6.666  -4.165  -0.117  1.00  0.00           H  
HETATM   29  H   UNL     1       4.993  -4.311  -0.094  1.00  0.00           H  
HETATM   30  H   UNL     1       7.673  -2.077  -0.099  1.00  0.00           H  
HETATM   31  H   UNL     1       3.878   3.216   0.049  1.00  0.00           H  
HETATM   32  H   UNL     1       0.568   0.116   0.034  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.391   2.072   0.126  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.012   2.254   0.988  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.036   2.289  -0.792  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.709   1.792   0.220  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.787  -0.101   0.952  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.811  -0.066  -0.827  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.815  -1.605   1.133  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.789  -3.065   0.957  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.795  -2.288  -0.239  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.834  -0.049  -1.261  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.869   1.422  -1.081  1.00  0.00           H  
CONECT    1    2    5    8    8                                       
CONECT    2    1   28   29                                            
CONECT    3    4    4                                                 
CONECT    4    3    3    5    7                                       
CONECT    5    1    4   30                                            
CONECT    6   16   16                                                 
CONECT    7    4   10   10   13                                       
CONECT    8    1    1   10                                            
CONECT    9   21   21                                                 
CONECT   10    7    7    8   11                                       
CONECT   11   10   12   12                                            
CONECT   12   11   11   14   16                                       
CONECT   13    7   14   14                                            
CONECT   14   12   13   13   31                                       
CONECT   15   16   18   32                                            
CONECT   16    6    6   12   15                                       
CONECT   17   20   21   33                                            
CONECT   18   15   20   34   35                                       
CONECT   19   21   22   36                                            
CONECT   20   17   18   37   38                                       
CONECT   21    9    9   17   19                                       
CONECT   22   19   23   23   27                                       
CONECT   23   22   22   24   39                                       
CONECT   24   23   25   25   40                                       
CONECT   25   24   24   26   41                                       
CONECT   26   25   27   27   42                                       
CONECT   27   22   26   26   43                                       
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    5                                                      
CONECT   31   14                                                      
CONECT   32   15                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   20                                                      
CONECT   39   23                                                      
CONECT   40   24                                                      
CONECT   41   25                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
