COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -7.839   0.449   1.387  1.00  0.00          Cl  
HETATM    2  C   UNL     1      -6.244   0.274   0.725  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.265  -0.386   1.446  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.994  -0.526   0.922  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.700  -0.003  -0.330  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.684   0.659  -1.052  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.954   0.791  -0.526  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.410  -0.139  -0.862  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.359  -0.762  -0.261  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.320  -0.658  -1.123  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.774   0.010  -2.189  1.00  0.00           N  
HETATM   12  N   UNL     1      -2.014   0.299  -2.007  1.00  0.00           N  
HETATM   13  C   UNL     1       1.077  -1.186  -0.918  1.00  0.00           C  
HETATM   14  C   UNL     1       1.459  -2.086  -2.094  1.00  0.00           C  
HETATM   15  O   UNL     1       1.992  -0.092  -0.838  1.00  0.00           O  
HETATM   16  C   UNL     1       3.147  -0.304  -0.165  1.00  0.00           C  
HETATM   17  C   UNL     1       4.092   0.795   0.075  1.00  0.00           C  
HETATM   18  C   UNL     1       3.829   2.088  -0.384  1.00  0.00           C  
HETATM   19  C   UNL     1       4.730   3.088  -0.145  1.00  0.00           C  
HETATM   20  C   UNL     1       5.903   2.829   0.550  1.00  0.00           C  
HETATM   21  C   UNL     1       6.182   1.560   1.011  1.00  0.00           C  
HETATM   22  C   UNL     1       5.279   0.528   0.779  1.00  0.00           C  
HETATM   23  N   UNL     1       5.531  -0.751   1.231  1.00  0.00           N  
HETATM   24  O   UNL     1       4.922  -2.868   1.423  1.00  0.00           O  
HETATM   25  C   UNL     1       4.661  -1.751   1.008  1.00  0.00           C  
HETATM   26  C   UNL     1       3.459  -1.545   0.315  1.00  0.00           C  
HETATM   27  H   UNL     1      -5.494  -0.792   2.421  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.231  -1.041   1.486  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.458   1.066  -2.026  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.720   1.306  -1.088  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.355  -1.241   0.706  1.00  0.00           H  
HETATM   32  H   UNL     1       1.116  -1.760   0.008  1.00  0.00           H  
HETATM   33  H   UNL     1       2.469  -2.468  -1.946  1.00  0.00           H  
HETATM   34  H   UNL     1       0.761  -2.921  -2.155  1.00  0.00           H  
HETATM   35  H   UNL     1       1.420  -1.512  -3.019  1.00  0.00           H  
HETATM   36  H   UNL     1       2.919   2.296  -0.927  1.00  0.00           H  
HETATM   37  H   UNL     1       4.527   4.087  -0.500  1.00  0.00           H  
HETATM   38  H   UNL     1       6.604   3.630   0.731  1.00  0.00           H  
HETATM   39  H   UNL     1       7.097   1.369   1.551  1.00  0.00           H  
HETATM   40  H   UNL     1       6.351  -0.932   1.717  1.00  0.00           H  
HETATM   41  H   UNL     1       2.780  -2.370   0.156  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    7    7    3    1                                       
CONECT    3    4    4    2   27                                       
CONECT    4    5    3    3   28                                       
CONECT    5    8    6    6    4                                       
CONECT    6    5    5    7   29                                       
CONECT    7    6    2    2   30                                       
CONECT    8    9   12    5                                            
CONECT    9   10   10    8   31                                       
CONECT   10   13   11    9    9                                       
CONECT   11   10   12   12                                            
CONECT   12   11   11    8                                            
CONECT   13   14   15   10   32                                       
CONECT   14   13   33   34   35                                       
CONECT   15   13   16                                                 
CONECT   16   26   26   15   17                                       
CONECT   17   16   22   22   18                                       
CONECT   18   17   19   19   36                                       
CONECT   19   18   18   20   37                                       
CONECT   20   21   21   19   38                                       
CONECT   21   22   20   20   39                                       
CONECT   22   23   17   17   21                                       
CONECT   23   25   22   40                                            
CONECT   24   25   25                                                 
CONECT   25   24   24   26   23                                       
CONECT   26   25   16   16   41                                       
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    9                                                      
CONECT   32   13                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
CONECT   40   23                                                      
CONECT   41   26                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
