COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.072  -3.207  -0.346  1.00  0.00           O  
HETATM    2  C   UNL     1       4.397  -2.210  -0.161  1.00  0.00           C  
HETATM    3  O   UNL     1       3.072  -2.269  -0.367  1.00  0.00           O  
HETATM    4  C   UNL     1       2.280  -1.193  -0.176  1.00  0.00           C  
HETATM    5  C   UNL     1       2.843   0.025   0.250  1.00  0.00           C  
HETATM    6  C   UNL     1       4.288   0.097   0.477  1.00  0.00           C  
HETATM    7  N   UNL     1       5.228   2.222  -0.233  1.00  0.00           N  
HETATM    8  C   UNL     1       4.937   1.378   0.933  1.00  0.00           C  
HETATM    9  C   UNL     1       5.863   3.483   0.174  1.00  0.00           C  
HETATM   10  C   UNL     1       5.027  -1.024   0.271  1.00  0.00           C  
HETATM   11  C   UNL     1       0.913  -1.271  -0.394  1.00  0.00           C  
HETATM   12  C   UNL     1       0.119  -0.155  -0.192  1.00  0.00           C  
HETATM   13  C   UNL     1       0.682   1.048   0.229  1.00  0.00           C  
HETATM   14  C   UNL     1       2.026   1.143   0.449  1.00  0.00           C  
HETATM   15  O   UNL     1      -1.220  -0.233  -0.406  1.00  0.00           O  
HETATM   16  C   UNL     1      -1.983   0.954  -0.180  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.437   0.678  -0.467  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.938   0.869  -1.741  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.271   0.616  -2.005  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.104   0.172  -0.996  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.603  -0.020   0.280  1.00  0.00           C  
HETATM   22 CL   UNL     1      -6.648  -0.578   1.548  1.00  0.00          Cl  
HETATM   23  C   UNL     1      -4.267   0.228   0.542  1.00  0.00           C  
HETATM   24  H   UNL     1       6.095  -1.007   0.433  1.00  0.00           H  
HETATM   25  H   UNL     1       4.262   1.908   1.605  1.00  0.00           H  
HETATM   26  H   UNL     1       5.865   1.149   1.457  1.00  0.00           H  
HETATM   27  H   UNL     1       4.393   2.395  -0.772  1.00  0.00           H  
HETATM   28  H   UNL     1       5.194   4.027   0.840  1.00  0.00           H  
HETATM   29  H   UNL     1       6.797   3.268   0.692  1.00  0.00           H  
HETATM   30  H   UNL     1       6.068   4.088  -0.709  1.00  0.00           H  
HETATM   31  H   UNL     1       2.457   2.078   0.775  1.00  0.00           H  
HETATM   32  H   UNL     1       0.051   1.911   0.383  1.00  0.00           H  
HETATM   33  H   UNL     1       0.469  -2.200  -0.721  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.871   1.265   0.858  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.627   1.746  -0.838  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.875   0.075   1.537  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.288   1.217  -2.530  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.662   0.766  -3.001  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.145  -0.025  -1.202  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1   10    3                                       
CONECT    3    2    4                                                 
CONECT    4    3   11    5    5                                       
CONECT    5    4    4   14    6                                       
CONECT    6    5    8   10   10                                       
CONECT    7    9   27    8                                            
CONECT    8    6    7   25   26                                       
CONECT    9    7   28   29   30                                       
CONECT   10    2    6    6   24                                       
CONECT   11    4   12   12   33                                       
CONECT   12   11   11   15   13                                       
CONECT   13   12   32   14   14                                       
CONECT   14    5   13   13   31                                       
CONECT   15   12   16                                                 
CONECT   16   15   17   34   35                                       
CONECT   17   16   23   18   18                                       
CONECT   18   17   17   19   37                                       
CONECT   19   18   20   20   38                                       
CONECT   20   19   19   21   39                                       
CONECT   21   20   22   23   23                                       
CONECT   22   21                                                      
CONECT   23   17   21   21   36                                       
CONECT   24   10                                                      
CONECT   25    8                                                      
CONECT   26    8                                                      
CONECT   27    7                                                      
CONECT   28    9                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31   14                                                      
CONECT   32   13                                                      
CONECT   33   11                                                      
CONECT   34   16                                                      
CONECT   35   16                                                      
CONECT   36   23                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
