COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -1.748   2.550  -0.170  1.00  0.00           O  
HETATM    2  S   UNL     1      -2.598   1.545   0.364  1.00  0.00           S  
HETATM    3  O   UNL     1      -3.326   1.645   1.581  1.00  0.00           O  
HETATM    4  N   UNL     1      -3.725   1.237  -0.810  1.00  0.00           N  
HETATM    5  C   UNL     1      -4.736   0.198  -0.600  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.855   0.361  -1.630  1.00  0.00           C  
HETATM    7  O   UNL     1      -5.336   0.124  -2.940  1.00  0.00           O  
HETATM    8  C   UNL     1      -1.596   0.104   0.523  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.153  -1.079   0.977  1.00  0.00           C  
HETATM   10 CL   UNL     1      -3.839  -1.138   1.389  1.00  0.00          Cl  
HETATM   11  C   UNL     1      -1.372  -2.215   1.104  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.032  -2.174   0.778  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.256   0.159   0.199  1.00  0.00           C  
HETATM   14  C   UNL     1       0.535  -0.984   0.320  1.00  0.00           C  
HETATM   15  C   UNL     1       1.972  -0.933  -0.031  1.00  0.00           C  
HETATM   16  C   UNL     1       2.725  -1.854  -0.673  1.00  0.00           C  
HETATM   17  C   UNL     1       2.122  -3.152  -1.144  1.00  0.00           C  
HETATM   18  N   UNL     1       4.035  -1.580  -0.884  1.00  0.00           N  
HETATM   19  S   UNL     1       3.163   0.356   0.289  1.00  0.00           S  
HETATM   20  C   UNL     1       4.545  -0.395  -0.445  1.00  0.00           C  
HETATM   21  N   UNL     1       5.792   0.068  -0.547  1.00  0.00           N  
HETATM   22  C   UNL     1       6.100   1.260  -0.052  1.00  0.00           C  
HETATM   23  O   UNL     1       5.245   1.930   0.496  1.00  0.00           O  
HETATM   24  C   UNL     1       7.508   1.783  -0.168  1.00  0.00           C  
HETATM   25  H   UNL     1      -3.715   1.745  -1.636  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.277  -0.784  -0.714  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.150   0.292   0.404  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.650  -0.355  -1.420  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.255   1.374  -1.576  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.071   0.236  -3.558  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.812  -3.135   1.458  1.00  0.00           H  
HETATM   32  H   UNL     1       0.576  -3.061   0.876  1.00  0.00           H  
HETATM   33  H   UNL     1       0.178   1.082  -0.154  1.00  0.00           H  
HETATM   34  H   UNL     1       2.889  -3.752  -1.635  1.00  0.00           H  
HETATM   35  H   UNL     1       1.725  -3.699  -0.289  1.00  0.00           H  
HETATM   36  H   UNL     1       1.317  -2.945  -1.849  1.00  0.00           H  
HETATM   37  H   UNL     1       4.603  -2.220  -1.342  1.00  0.00           H  
HETATM   38  H   UNL     1       7.569   2.769   0.293  1.00  0.00           H  
HETATM   39  H   UNL     1       8.192   1.102   0.340  1.00  0.00           H  
HETATM   40  H   UNL     1       7.783   1.856  -1.220  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    3                                       
CONECT    2    4    8                                                 
CONECT    3    2    2                                                 
CONECT    4    2    5   25                                            
CONECT    5    4    6   26   27                                       
CONECT    6    5    7   28   29                                       
CONECT    7    6   30                                                 
CONECT    8    2    9    9   13                                       
CONECT    9    8    8   10   11                                       
CONECT   10    9                                                      
CONECT   11    9   12   12   31                                       
CONECT   12   11   11   14   32                                       
CONECT   13    8   14   14   33                                       
CONECT   14   12   13   13   15                                       
CONECT   15   14   16   16   19                                       
CONECT   16   15   15   17   18                                       
CONECT   17   16   34   35   36                                       
CONECT   18   16   20   37                                            
CONECT   19   15   20                                                 
CONECT   20   18   19   21   21                                       
CONECT   21   20   20   22                                            
CONECT   22   21   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   38   39   40                                       
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   24                                                      
CONECT   39   24                                                      
CONECT   40   24                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
