COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.774   2.740  -1.175  1.00  0.00           N  
HETATM    2  N   UNL     1      -4.668   1.263   0.860  1.00  0.00           N  
HETATM    3  C   UNL     1       3.014  -0.544   0.671  1.00  0.00           C  
HETATM    4  C   UNL     1       4.899   0.823   0.197  1.00  0.00           C  
HETATM    5  C   UNL     1       4.181   1.825  -0.421  1.00  0.00           C  
HETATM    6  C   UNL     1       6.069   2.760  -1.385  1.00  0.00           C  
HETATM    7  C   UNL     1       6.894   1.784  -0.803  1.00  0.00           C  
HETATM    8  C   UNL     1       9.036   0.799  -0.413  1.00  0.00           C  
HETATM    9  C   UNL     1       6.299   0.786   0.011  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.420  -1.282   0.816  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.253   0.930   0.852  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.738  -0.957   0.474  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.554   2.082   0.259  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.747   1.523  -0.386  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.702   1.306  -1.419  1.00  0.00           C  
HETATM   16  O   UNL     1      -5.364   3.283   0.250  1.00  0.00           O  
HETATM   17  O   UNL     1      -7.010   0.212  -0.568  1.00  0.00           O  
HETATM   18  C   UNL     1      -8.188   0.077  -1.191  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.790   2.239  -0.902  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.402   1.786   1.396  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.944  -0.174   1.004  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.517  -0.484   1.149  1.00  0.00           N  
HETATM   23  C   UNL     1      -1.579  -2.356  -0.051  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.491  -3.143  -0.379  1.00  0.00           C  
HETATM   25 CL   UNL     1      -0.687  -4.485  -1.463  1.00  0.00          Cl  
HETATM   26  C   UNL     1      -0.168  -1.000   1.345  1.00  0.00           C  
HETATM   27  C   UNL     1       0.917  -1.787   1.009  1.00  0.00           C  
HETATM   28  C   UNL     1       0.755  -2.862   0.155  1.00  0.00           C  
HETATM   29  C   UNL     1       2.275  -1.484   1.588  1.00  0.00           C  
HETATM   30  O   UNL     1       2.490  -0.159  -0.352  1.00  0.00           O  
HETATM   31  N   UNL     1       4.258  -0.133   0.988  1.00  0.00           N  
HETATM   32  C   UNL     1       7.104  -0.197   0.602  1.00  0.00           C  
HETATM   33  C   UNL     1       8.449  -0.180   0.386  1.00  0.00           C  
HETATM   34  C   UNL     1       8.284   1.769  -1.002  1.00  0.00           C  
HETATM   35  H   UNL     1       3.110   1.865  -0.288  1.00  0.00           H  
HETATM   36  H   UNL     1       6.502   3.528  -2.008  1.00  0.00           H  
HETATM   37  H   UNL     1      10.105   0.789  -0.567  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.177   1.067  -0.226  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.319   1.233   1.325  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.874  -2.020   0.671  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.646  -0.794  -0.600  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.641   1.528  -1.904  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.649  -0.859  -1.469  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.889   3.314  -0.915  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.269   2.820   1.080  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.415   1.731   2.485  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.103  -0.413   2.055  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.832  -0.436   0.428  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.550  -2.576  -0.468  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.041  -0.165   2.019  1.00  0.00           H  
HETATM   51  H   UNL     1       1.604  -3.476  -0.105  1.00  0.00           H  
HETATM   52  H   UNL     1       2.840  -2.410   1.692  1.00  0.00           H  
HETATM   53  H   UNL     1       2.157  -1.018   2.567  1.00  0.00           H  
HETATM   54  H   UNL     1       4.707  -0.500   1.765  1.00  0.00           H  
HETATM   55  H   UNL     1       6.662  -0.961   1.223  1.00  0.00           H  
HETATM   56  H   UNL     1       9.070  -0.938   0.841  1.00  0.00           H  
HETATM   57  H   UNL     1       8.752   2.522  -1.619  1.00  0.00           H  
CONECT    1    6    5    5                                            
CONECT    2   21   20   13                                            
CONECT    3   31   29   30   30                                       
CONECT    4    9    9    5   31                                       
CONECT    5    1    1    4   35                                       
CONECT    6    7    7    1   36                                       
CONECT    7   34    6    6    9                                       
CONECT    8   34   34   33   37                                       
CONECT    9    7   32    4    4                                       
CONECT   10   26   26   23   22                                       
CONECT   11   22   20   38   39                                       
CONECT   12   22   21   40   41                                       
CONECT   13    2   14   16   16                                       
CONECT   14   19   19   13   17                                       
CONECT   15   19   18   18   42                                       
CONECT   16   13   13                                                 
CONECT   17   14   18                                                 
CONECT   18   15   15   17   43                                       
CONECT   19   15   14   14   44                                       
CONECT   20   11    2   45   46                                       
CONECT   21   12    2   47   48                                       
CONECT   22   10   12   11                                            
CONECT   23   24   24   10   49                                       
CONECT   24   28   25   23   23                                       
CONECT   25   24                                                      
CONECT   26   27   10   10   50                                       
CONECT   27   29   28   28   26                                       
CONECT   28   27   27   24   51                                       
CONECT   29    3   27   52   53                                       
CONECT   30    3    3                                                 
CONECT   31    4    3   54                                            
CONECT   32   33   33    9   55                                       
CONECT   33    8   32   32   56                                       
CONECT   34    8    8    7   57                                       
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    8                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   15                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   23                                                      
CONECT   50   26                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   31                                                      
CONECT   55   32                                                      
CONECT   56   33                                                      
CONECT   57   34                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
