COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.817  -0.718  -0.303  1.00  0.00           N  
HETATM    2  O   UNL     1       3.772  -0.370   2.126  1.00  0.00           O  
HETATM    3  C   UNL     1       3.731  -0.836   1.004  1.00  0.00           C  
HETATM    4  N   UNL     1       4.578  -1.826   0.665  1.00  0.00           N  
HETATM    5  C   UNL     1       4.546  -2.354  -0.575  1.00  0.00           C  
HETATM    6  O   UNL     1       5.311  -3.249  -0.882  1.00  0.00           O  
HETATM    7  C   UNL     1       3.612  -1.857  -1.517  1.00  0.00           C  
HETATM    8  C   UNL     1       2.774  -0.864  -1.150  1.00  0.00           C  
HETATM    9  N   UNL     1       2.836  -0.359   0.120  1.00  0.00           N  
HETATM   10  C   UNL     1       1.924   0.715   0.519  1.00  0.00           C  
HETATM   11  O   UNL     1       0.558   0.350   0.225  1.00  0.00           O  
HETATM   12  C   UNL     1       2.185   1.984  -0.322  1.00  0.00           C  
HETATM   13  O   UNL     1       3.006   2.904   0.400  1.00  0.00           O  
HETATM   14  C   UNL     1       0.778   2.579  -0.553  1.00  0.00           C  
HETATM   15  O   UNL     1       0.687   3.885   0.019  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.168   1.597   0.179  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.470   1.427  -0.606  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.398   0.591   0.160  1.00  0.00           N  
HETATM   19  C   UNL     1      -3.616   0.305  -0.339  1.00  0.00           C  
HETATM   20  O   UNL     1      -3.945   0.739  -1.423  1.00  0.00           O  
HETATM   21  C   UNL     1      -4.570  -0.556   0.449  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.938  -1.928   0.691  1.00  0.00           C  
HETATM   23  N   UNL     1      -6.686  -1.260   0.160  1.00  0.00           N1+
HETATM   24  H   UNL     1       5.215  -2.161   1.316  1.00  0.00           H  
HETATM   25  H   UNL     1       3.572  -2.267  -2.515  1.00  0.00           H  
HETATM   26  H   UNL     1       2.056  -0.473  -1.855  1.00  0.00           H  
HETATM   27  H   UNL     1       2.038   0.934   1.581  1.00  0.00           H  
HETATM   28  H   UNL     1       2.650   1.722  -1.273  1.00  0.00           H  
HETATM   29  H   UNL     1       3.152   3.743  -0.057  1.00  0.00           H  
HETATM   30  H   UNL     1       0.547   2.611  -1.617  1.00  0.00           H  
HETATM   31  H   UNL     1       1.303   4.525  -0.364  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.378   1.953   1.188  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.921   2.405  -0.779  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.258   0.951  -1.564  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.134   0.243   1.026  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.783  -0.080   1.406  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.010  -1.807   1.251  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.628  -2.550   1.261  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.725  -2.404  -0.266  1.00  0.00           H  
HETATM   40  N   UNL     1      -7.555  -1.803   0.623  1.00  0.00           N  
HETATM   41  H   UNL     1      -7.645  -2.762   0.507  1.00  0.00           H  
CONECT    1   23   23   21                                            
CONECT    2    3    3                                                 
CONECT    3    2    2    9    4                                       
CONECT    4    3    5   24                                            
CONECT    5    4    7    6    6                                       
CONECT    6    5    5                                                 
CONECT    7    8    8    5   25                                       
CONECT    8    9    7    7   26                                       
CONECT    9   10    3    8                                            
CONECT   10   12   11    9   27                                       
CONECT   11   16   10                                                 
CONECT   12   13   14   10   28                                       
CONECT   13   12   29                                                 
CONECT   14   15   16   12   30                                       
CONECT   15   14   31                                                 
CONECT   16   14   17   11   32                                       
CONECT   17   16   18   33   34                                       
CONECT   18   17   19   35                                            
CONECT   19   20   20   18   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22    1   36                                       
CONECT   22   21   37   38   39                                       
CONECT   23    1    1   40   40                                       
CONECT   24    4                                                      
CONECT   25    7                                                      
CONECT   26    8                                                      
CONECT   27   10                                                      
CONECT   28   12                                                      
CONECT   29   13                                                      
CONECT   30   14                                                      
CONECT   31   15                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   21                                                      
CONECT   37   22                                                      
CONECT   38   22                                                      
CONECT   39   22                                                      
CONECT   40   23   23   41                                            
CONECT   41   40                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
