COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -2.151  -0.318   4.549  1.00  0.00          Cl  
HETATM    2  C   UNL     1      -0.628  -0.002   2.318  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.916  -0.165   2.836  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.003  -0.194   1.983  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.820  -0.073   0.619  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.542   0.083   0.095  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.445   0.119   0.940  1.00  0.00           C  
HETATM    8  O   UNL     1       0.374  -0.071   4.425  1.00  0.00           O  
HETATM    9  C   UNL     1       0.535   0.035   3.226  1.00  0.00           C  
HETATM   10  O   UNL     1       1.776   0.187   2.724  1.00  0.00           O  
HETATM   11  C   UNL     1       2.921   0.224   3.617  1.00  0.00           C  
HETATM   12  C   UNL     1       4.149  -0.334   2.895  1.00  0.00           C  
HETATM   13  C   UNL     1       3.192   1.669   4.040  1.00  0.00           C  
HETATM   14  O   UNL     1       1.532  -0.455  -5.096  1.00  0.00           O  
HETATM   15  C   UNL     1       1.082  -0.569  -3.854  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.013  -0.066  -3.296  1.00  0.00           C  
HETATM   17  S   UNL     1      -1.185   0.867  -4.229  1.00  0.00           S  
HETATM   18  C   UNL     1      -0.186   1.116  -5.734  1.00  0.00           C  
HETATM   19  C   UNL     1       0.497  -0.226  -6.038  1.00  0.00           C  
HETATM   20  C   UNL     1       1.945  -1.395  -2.935  1.00  0.00           C  
HETATM   21  O   UNL     1       0.536  -0.943  -1.213  1.00  0.00           O  
HETATM   22  C   UNL     1      -0.258  -0.297  -1.871  1.00  0.00           C  
HETATM   23  N   UNL     1      -1.364   0.204  -1.287  1.00  0.00           N  
HETATM   24  H   UNL     1      -3.998  -0.316   2.385  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.674  -0.101  -0.041  1.00  0.00           H  
HETATM   26  H   UNL     1       0.547   0.242   0.533  1.00  0.00           H  
HETATM   27  H   UNL     1       2.713  -0.379   4.500  1.00  0.00           H  
HETATM   28  H   UNL     1       5.008  -0.306   3.565  1.00  0.00           H  
HETATM   29  H   UNL     1       3.956  -1.363   2.594  1.00  0.00           H  
HETATM   30  H   UNL     1       4.357   0.270   2.012  1.00  0.00           H  
HETATM   31  H   UNL     1       3.400   2.273   3.157  1.00  0.00           H  
HETATM   32  H   UNL     1       2.317   2.067   4.554  1.00  0.00           H  
HETATM   33  H   UNL     1       4.051   1.697   4.710  1.00  0.00           H  
HETATM   34  H   UNL     1       0.565   1.887  -5.563  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.832   1.401  -6.564  1.00  0.00           H  
HETATM   36  H   UNL     1       0.920  -0.198  -7.042  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.235  -1.030  -5.975  1.00  0.00           H  
HETATM   38  H   UNL     1       2.813  -1.760  -3.483  1.00  0.00           H  
HETATM   39  H   UNL     1       2.275  -0.781  -2.097  1.00  0.00           H  
HETATM   40  H   UNL     1       1.369  -2.242  -2.560  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.037   0.650  -1.825  1.00  0.00           H  
CONECT    1    3                                                      
CONECT    2    3    3    7    9                                       
CONECT    3    1    2    2    4                                       
CONECT    4    3    5    5   24                                       
CONECT    5    4    4    6   25                                       
CONECT    6    5    7    7   23                                       
CONECT    7    2    6    6   26                                       
CONECT    8    9    9                                                 
CONECT    9    2    8    8   10                                       
CONECT   10    9   11                                                 
CONECT   11   10   12   13   27                                       
CONECT   12   11   28   29   30                                       
CONECT   13   11   31   32   33                                       
CONECT   14   15   19                                                 
CONECT   15   14   16   16   20                                       
CONECT   16   15   15   17   22                                       
CONECT   17   16   18                                                 
CONECT   18   17   19   34   35                                       
CONECT   19   14   18   36   37                                       
CONECT   20   15   38   39   40                                       
CONECT   21   22   22                                                 
CONECT   22   16   21   21   23                                       
CONECT   23    6   22   41                                            
CONECT   24    4                                                      
CONECT   25    5                                                      
CONECT   26    7                                                      
CONECT   27   11                                                      
CONECT   28   12                                                      
CONECT   29   12                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   23                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
