COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.903   2.421   1.235  1.00  0.00           C  
HETATM    2  O   UNL     1       6.634   2.504   0.584  1.00  0.00           O  
HETATM    3  C   UNL     1       6.054   1.332   0.211  1.00  0.00           C  
HETATM    4  C   UNL     1       4.822   1.339  -0.426  1.00  0.00           C  
HETATM    5  C   UNL     1       6.697   0.129   0.462  1.00  0.00           C  
HETATM    6  C   UNL     1       6.105  -1.062   0.082  1.00  0.00           C  
HETATM    7 CL   UNL     1       6.908  -2.569   0.396  1.00  0.00          Cl  
HETATM    8  C   UNL     1       4.873  -1.052  -0.548  1.00  0.00           C  
HETATM    9  C   UNL     1       4.234   0.147  -0.804  1.00  0.00           C  
HETATM   10  C   UNL     1       2.893   0.153  -1.490  1.00  0.00           C  
HETATM   11  N   UNL     1       1.826   0.082  -0.482  1.00  0.00           N  
HETATM   12  C   UNL     1       0.501   0.087  -1.116  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.581   0.012  -0.037  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.961   0.016  -0.697  1.00  0.00           C  
HETATM   15  N   UNL     1      -2.997  -0.055   0.336  1.00  0.00           N  
HETATM   16  C   UNL     1      -4.298  -0.064  -0.014  1.00  0.00           C  
HETATM   17  O   UNL     1      -4.613  -0.013  -1.187  1.00  0.00           O  
HETATM   18  N   UNL     1      -5.251  -0.130   0.937  1.00  0.00           N  
HETATM   19  C   UNL     1      -6.610  -0.025   0.581  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.034   0.629  -0.567  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.354   0.635  -0.755  1.00  0.00           C  
HETATM   22  S   UNL     1      -9.144  -0.219   0.563  1.00  0.00           S  
HETATM   23  C   UNL     1      -7.592  -0.554   1.319  1.00  0.00           C  
HETATM   24  H   UNL     1       7.804   1.839   2.151  1.00  0.00           H  
HETATM   25  H   UNL     1       8.620   1.937   0.573  1.00  0.00           H  
HETATM   26  H   UNL     1       8.252   3.425   1.479  1.00  0.00           H  
HETATM   27  H   UNL     1       4.322   2.275  -0.625  1.00  0.00           H  
HETATM   28  H   UNL     1       7.659   0.121   0.954  1.00  0.00           H  
HETATM   29  H   UNL     1       4.412  -1.983  -0.844  1.00  0.00           H  
HETATM   30  H   UNL     1       2.785   1.071  -2.069  1.00  0.00           H  
HETATM   31  H   UNL     1       2.821  -0.707  -2.156  1.00  0.00           H  
HETATM   32  H   UNL     1       1.910   0.834   0.186  1.00  0.00           H  
HETATM   33  H   UNL     1       0.377   1.004  -1.692  1.00  0.00           H  
HETATM   34  H   UNL     1       0.413  -0.774  -1.779  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.456  -0.905   0.539  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.492   0.872   0.627  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.085   0.933  -1.273  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.049  -0.844  -1.360  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.746  -0.096   1.273  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.002  -0.250   1.867  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.346   1.098  -1.256  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.861   1.095  -1.590  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.453  -1.098   2.242  1.00  0.00           H  
CONECT    1    2   24   25   26                                       
CONECT    2    1    3                                                 
CONECT    3    4    4    5    2                                       
CONECT    4    9    3    3   27                                       
CONECT    5    6    6    3   28                                       
CONECT    6    8    7    5    5                                       
CONECT    7    6                                                      
CONECT    8    9    9    6   29                                       
CONECT    9   10    8    8    4                                       
CONECT   10   11    9   30   31                                       
CONECT   11   12   10   32                                            
CONECT   12   13   11   33   34                                       
CONECT   13   14   12   35   36                                       
CONECT   14   15   13   37   38                                       
CONECT   15   16   14   39                                            
CONECT   16   18   17   17   15                                       
CONECT   17   16   16                                                 
CONECT   18   19   16   40                                            
CONECT   19   20   23   23   18                                       
CONECT   20   21   21   19   41                                       
CONECT   21   22   20   20   42                                       
CONECT   22   21   23                                                 
CONECT   23   22   19   19   43                                       
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    8                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   23                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
