COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.604  -1.801  -0.177  1.00  0.00           C  
HETATM    2  O   UNL     1       2.766  -2.988  -0.390  1.00  0.00           O  
HETATM    3  N   UNL     1       3.658  -0.965  -0.036  1.00  0.00           N  
HETATM    4  C   UNL     1       3.464   0.366   0.203  1.00  0.00           C  
HETATM    5  N   UNL     1       4.565   1.174   0.339  1.00  0.00           N  
HETATM    6  N   UNL     1       2.277   0.906   0.309  1.00  0.00           N  
HETATM    7  C   UNL     1       1.146   0.167   0.185  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.114   0.749   0.298  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.243   2.227   0.563  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.297   2.981  -0.768  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.423   4.422  -0.510  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.246  -0.034   0.166  1.00  0.00           C  
HETATM   13  N   UNL     1      -2.602   0.239   0.225  1.00  0.00           N  
HETATM   14  C   UNL     1      -3.264  -0.939   0.019  1.00  0.00           C  
HETATM   15  N   UNL     1      -4.635  -1.084   0.002  1.00  0.00           N  
HETATM   16  C   UNL     1      -5.497   0.082   0.217  1.00  0.00           C  
HETATM   17  N   UNL     1      -2.405  -1.910  -0.161  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.138  -1.418  -0.082  1.00  0.00           C  
HETATM   19  C   UNL     1       0.117  -2.008  -0.197  1.00  0.00           C  
HETATM   20  C   UNL     1       1.257  -1.223  -0.070  1.00  0.00           C  
HETATM   21  H   UNL     1       4.561  -1.313  -0.105  1.00  0.00           H  
HETATM   22  H   UNL     1       5.456   0.797   0.265  1.00  0.00           H  
HETATM   23  H   UNL     1       4.453   2.122   0.510  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.157   2.417   1.125  1.00  0.00           H  
HETATM   25  H   UNL     1       0.616   2.569   1.140  1.00  0.00           H  
HETATM   26  H   UNL     1       0.617   2.791  -1.330  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.156   2.639  -1.344  1.00  0.00           H  
HETATM   28  H   UNL     1       0.328   4.751   0.078  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.461   4.942  -1.373  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.007   1.106   0.383  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.029  -1.957  -0.151  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.301   0.825  -0.556  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.542  -0.226   0.169  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.289   0.512   1.196  1.00  0.00           H  
HETATM   35  H   UNL     1       0.204  -3.068  -0.387  1.00  0.00           H  
CONECT    1    2    2    3   20                                       
CONECT    2    1    1                                                 
CONECT    3    1    4   21                                            
CONECT    4    3    5    6    6                                       
CONECT    5    4   22   23                                            
CONECT    6    4    4    7                                            
CONECT    7    6    8    8   20                                       
CONECT    8    7    7    9   12                                       
CONECT    9    8   10   24   25                                       
CONECT   10    9   11   26   27                                       
CONECT   11   10   28   29                                            
CONECT   12    8   13   18   18                                       
CONECT   13   12   14   30                                            
CONECT   14   13   15   17   17                                       
CONECT   15   14   16   31                                            
CONECT   16   15   32   33   34                                       
CONECT   17   14   14   18                                            
CONECT   18   12   12   17   19                                       
CONECT   19   18   20   20   35                                       
CONECT   20    1    7   19   19                                       
CONECT   21    3                                                      
CONECT   22    5                                                      
CONECT   23    5                                                      
CONECT   24    9                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   10                                                      
CONECT   28   11                                                      
CONECT   29   11                                                      
CONECT   30   13                                                      
CONECT   31   15                                                      
CONECT   32   16                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   19                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
