COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.000  -1.428   0.016  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.247  -0.546  -0.082  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.492  -1.431  -0.161  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.720  -0.562  -0.258  1.00  0.00           C  
HETATM    5  S   UNL     1      -4.663   0.059   1.098  1.00  0.00           S  
HETATM    6  N   UNL     1      -4.266  -0.135  -1.350  1.00  0.00           N  
HETATM    7  N   UNL     1      -5.295   0.587  -1.253  1.00  0.00           N  
HETATM    8  C   UNL     1      -5.736   0.854  -0.057  1.00  0.00           C  
HETATM    9  N   UNL     1      -6.845   1.626   0.254  1.00  0.00           N  
HETATM   10  H   UNL     1      -0.063  -2.047   0.911  1.00  0.00           H  
HETATM   11  H   UNL     1       0.063  -2.068  -0.864  1.00  0.00           H  
HETATM   12  H   UNL     1      -1.310   0.093   0.798  1.00  0.00           H  
HETATM   13  H   UNL     1      -2.429  -2.070  -1.041  1.00  0.00           H  
HETATM   14  H   UNL     1      -2.556  -2.050   0.734  1.00  0.00           H  
HETATM   15  H   UNL     1      -7.092   1.769   1.181  1.00  0.00           H  
HETATM   16  H   UNL     1      -7.374   2.022  -0.456  1.00  0.00           H  
HETATM   17  C   UNL     1       1.246  -0.544   0.095  1.00  0.00           C  
HETATM   18  C   UNL     1       2.492  -1.426   0.193  1.00  0.00           C  
HETATM   19  C   UNL     1       3.719  -0.555   0.271  1.00  0.00           C  
HETATM   20  S   UNL     1       4.666   0.030  -1.099  1.00  0.00           S  
HETATM   21  C   UNL     1       5.735   0.855   0.038  1.00  0.00           C  
HETATM   22  N   UNL     1       5.294   0.618   1.240  1.00  0.00           N  
HETATM   23  N   UNL     1       4.262  -0.098   1.352  1.00  0.00           N  
HETATM   24  N   UNL     1       6.846   1.619  -0.290  1.00  0.00           N  
HETATM   25  H   UNL     1      -1.184   0.073  -0.977  1.00  0.00           H  
HETATM   26  H   UNL     1       1.309   0.075  -0.800  1.00  0.00           H  
HETATM   27  H   UNL     1       1.182   0.095   0.975  1.00  0.00           H  
HETATM   28  H   UNL     1       2.429  -2.045   1.088  1.00  0.00           H  
HETATM   29  H   UNL     1       2.555  -2.065  -0.687  1.00  0.00           H  
HETATM   30  H   UNL     1       7.095   1.737  -1.220  1.00  0.00           H  
HETATM   31  H   UNL     1       7.373   2.035   0.410  1.00  0.00           H  
CONECT    1    2   10   11   17                                       
CONECT    2    1    3   12   25                                       
CONECT    3    4    2   13   14                                       
CONECT    4    5    3    6    6                                       
CONECT    5    8    4                                                 
CONECT    6    4    4    7                                            
CONECT    7    8    8    6                                            
CONECT    8    9    5    7    7                                       
CONECT    9    8   15   16                                            
CONECT   10    1                                                      
CONECT   11    1                                                      
CONECT   12    2                                                      
CONECT   13    3                                                      
CONECT   14    3                                                      
CONECT   15    9                                                      
CONECT   16    9                                                      
CONECT   17    1   18   26   27                                       
CONECT   18   17   19   28   29                                       
CONECT   19   18   20   23   23                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   22   24                                       
CONECT   22   21   21   23                                            
CONECT   23   22   19   19                                            
CONECT   24   21   30   31                                            
CONECT   25    2                                                      
CONECT   26   17                                                      
CONECT   27   17                                                      
CONECT   28   18                                                      
CONECT   29   18                                                      
CONECT   30   24                                                      
CONECT   31   24                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
