COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.867   0.079   3.000  1.00  0.00           C  
HETATM    2  N   UNL     1       0.204   0.084  -5.088  1.00  0.00           N  
HETATM    3  C   UNL     1       1.549   0.276  -5.187  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.595   0.177  -6.195  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.021   0.486  -7.442  1.00  0.00           C  
HETATM    6  C   UNL     1       1.323   0.682  -7.529  1.00  0.00           C  
HETATM    7  C   UNL     1       2.116   0.574  -6.376  1.00  0.00           C  
HETATM    8  C   UNL     1       0.981  -1.122  -2.325  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.202  -0.432  -2.626  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.615  -0.228  -4.024  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.897  -0.306  -4.525  1.00  0.00           C  
HETATM   12  C   UNL     1       1.326  -1.288  -0.999  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.944   0.266   1.979  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.577  -0.149  -0.366  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.951   0.029  -1.622  1.00  0.00           N  
HETATM   16  C   UNL     1       0.407   0.371   2.281  1.00  0.00           C  
HETATM   17  C   UNL     1       0.829   0.290   3.593  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.092   0.104   4.607  1.00  0.00           C  
HETATM   19  O   UNL     1       1.815  -0.390   6.220  1.00  0.00           O  
HETATM   20  S   UNL     1       0.450   0.000   6.280  1.00  0.00           S  
HETATM   21  O   UNL     1      -0.574  -0.696   6.976  1.00  0.00           O  
HETATM   22  N   UNL     1       0.448   1.536   6.898  1.00  0.00           N  
HETATM   23  C   UNL     1      -1.438  -0.006   4.310  1.00  0.00           C  
HETATM   24  N   UNL     1      -1.374   0.348   0.652  1.00  0.00           N  
HETATM   25  N   UNL     1       0.536  -0.797  -0.056  1.00  0.00           N  
HETATM   26  N   UNL     1      -1.851  -0.057  -5.828  1.00  0.00           N  
HETATM   27  H   UNL     1      -2.919  -0.001   2.769  1.00  0.00           H  
HETATM   28  H   UNL     1       2.167   0.194  -4.305  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.641   0.567  -8.323  1.00  0.00           H  
HETATM   30  H   UNL     1       1.777   0.919  -8.480  1.00  0.00           H  
HETATM   31  H   UNL     1       3.183   0.728  -6.441  1.00  0.00           H  
HETATM   32  H   UNL     1       1.608  -1.512  -3.113  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.786  -0.531  -3.955  1.00  0.00           H  
HETATM   34  H   UNL     1       2.231  -1.814  -0.733  1.00  0.00           H  
HETATM   35  H   UNL     1       1.128   0.517   1.489  1.00  0.00           H  
HETATM   36  H   UNL     1       1.880   0.372   3.828  1.00  0.00           H  
HETATM   37  H   UNL     1       0.719   1.690   7.816  1.00  0.00           H  
HETATM   38  H   UNL     1       0.181   2.283   6.339  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.155  -0.151   5.104  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.231   0.753   0.444  1.00  0.00           H  
CONECT    1   13   13   23   27                                       
CONECT    2    3    4   10                                            
CONECT    3    2    7    7   28                                       
CONECT    4    2    5   26   26                                       
CONECT    5    4    6    6   29                                       
CONECT    6    5    5    7   30                                       
CONECT    7    3    3    6   31                                       
CONECT    8    9    9   12   32                                       
CONECT    9    8    8   10   15                                       
CONECT   10    2    9   11   11                                       
CONECT   11   10   10   26   33                                       
CONECT   12    8   25   25   34                                       
CONECT   13    1    1   16   24                                       
CONECT   14   15   15   24   25                                       
CONECT   15    9   14   14                                            
CONECT   16   13   17   17   35                                       
CONECT   17   16   16   18   36                                       
CONECT   18   17   20   23   23                                       
CONECT   19   20   20                                                 
CONECT   20   18   19   19   21                                       
CONECT   20   21   22                                                 
CONECT   21   20   20                                                 
CONECT   22   20   37   38                                            
CONECT   23    1   18   18   39                                       
CONECT   24   13   14   40                                            
CONECT   25   12   12   14                                            
CONECT   26    4    4   11                                            
CONECT   27    1                                                      
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   22                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   24                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
