COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.710  -0.109  -0.323  1.00  0.00           C  
HETATM    2  C   UNL     1       4.034  -0.487  -0.196  1.00  0.00           C  
HETATM    3  S   UNL     1       4.936  -1.977  -0.482  1.00  0.00           S  
HETATM    4  N   UNL     1       6.325  -1.395  -0.052  1.00  0.00           N  
HETATM    5  N   UNL     1       6.210  -0.177   0.295  1.00  0.00           N  
HETATM    6  C   UNL     1       5.013   0.420   0.257  1.00  0.00           C  
HETATM    7  C   UNL     1       4.605   1.729   0.578  1.00  0.00           C  
HETATM    8  C   UNL     1       3.300   2.092   0.449  1.00  0.00           C  
HETATM    9  C   UNL     1       2.339   1.185   0.001  1.00  0.00           C  
HETATM   10  N   UNL     1       1.004   1.585  -0.129  1.00  0.00           N  
HETATM   11  C   UNL     1       0.011   0.701   0.096  1.00  0.00           C  
HETATM   12  O   UNL     1       0.271  -0.414   0.503  1.00  0.00           O  
HETATM   13  N   UNL     1      -1.270   1.055  -0.132  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.349   0.094   0.112  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.673   0.732  -0.219  1.00  0.00           C  
HETATM   16  O   UNL     1      -3.712   1.877  -0.618  1.00  0.00           O  
HETATM   17  C   UNL     1      -4.920  -0.033  -0.056  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.151   0.556  -0.361  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.314  -0.168  -0.206  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.266  -1.473   0.250  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.051  -2.063   0.555  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.879  -1.355   0.399  1.00  0.00           C  
HETATM   23  H   UNL     1       1.973  -0.816  -0.676  1.00  0.00           H  
HETATM   24  H   UNL     1       5.331   2.448   0.928  1.00  0.00           H  
HETATM   25  H   UNL     1       3.002   3.100   0.700  1.00  0.00           H  
HETATM   26  H   UNL     1       0.793   2.498  -0.380  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.477   1.945  -0.458  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.202  -0.784  -0.517  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.340  -0.203   1.160  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.190   1.575  -0.717  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.266   0.285  -0.442  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.181  -2.035   0.370  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.022  -3.082   0.911  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.931  -1.818   0.632  1.00  0.00           H  
CONECT    1    2    9    9   23                                       
CONECT    2    3    6    6    1                                       
CONECT    3    4    2                                                 
CONECT    4    5    5    3                                            
CONECT    5    4    4    6                                            
CONECT    6    5    2    2    7                                       
CONECT    7    6    8    8   24                                       
CONECT    8    7    7    9   25                                       
CONECT    9    1    1    8   10                                       
CONECT   10    9   11   26                                            
CONECT   11   12   12   10   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   27                                            
CONECT   14   13   15   28   29                                       
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   22   22   18                                       
CONECT   18   17   19   19   30                                       
CONECT   19   18   18   20   31                                       
CONECT   20   21   21   19   32                                       
CONECT   21   22   20   20   33                                       
CONECT   22   17   17   21   34                                       
CONECT   23    1                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26   10                                                      
CONECT   27   13                                                      
CONECT   28   14                                                      
CONECT   29   14                                                      
CONECT   30   18                                                      
CONECT   31   19                                                      
CONECT   32   20                                                      
CONECT   33   21                                                      
CONECT   34   22                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
