COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.923  -1.599  -0.293  1.00  0.00           C  
HETATM    2  N   UNL     1       5.538  -1.232  -0.599  1.00  0.00           N  
HETATM    3  C   UNL     1       4.818  -0.517   0.288  1.00  0.00           C  
HETATM    4  O   UNL     1       5.319  -0.177   1.343  1.00  0.00           O  
HETATM    5  C   UNL     1       3.425  -0.147  -0.020  1.00  0.00           C  
HETATM    6  C   UNL     1       2.272  -0.903   0.282  1.00  0.00           C  
HETATM    7  C   UNL     1       2.230  -2.236   0.985  1.00  0.00           C  
HETATM    8  C   UNL     1       3.004   1.002  -0.664  1.00  0.00           C  
HETATM    9  C   UNL     1       3.900   2.100  -1.177  1.00  0.00           C  
HETATM   10  N   UNL     1       1.664   0.977  -0.758  1.00  0.00           N  
HETATM   11  C   UNL     1       1.189  -0.182  -0.180  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.166  -0.566  -0.085  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.146   0.392   0.081  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.612   0.196   0.045  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.421  -0.921  -0.137  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.795  -0.784  -0.110  1.00  0.00           C  
HETATM   17 CL   UNL     1      -5.810  -2.172  -0.344  1.00  0.00          Cl  
HETATM   18  C   UNL     1      -5.364   0.462   0.104  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.570   1.575   0.292  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.185   1.456   0.268  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.172   2.396   0.425  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.958   1.829   0.325  1.00  0.00           C  
HETATM   23  O   UNL     1       0.111   2.405   0.420  1.00  0.00           O  
HETATM   24  H   UNL     1       7.513  -0.695  -0.142  1.00  0.00           H  
HETATM   25  H   UNL     1       6.946  -2.204   0.613  1.00  0.00           H  
HETATM   26  H   UNL     1       7.339  -2.171  -1.123  1.00  0.00           H  
HETATM   27  H   UNL     1       5.139  -1.503  -1.441  1.00  0.00           H  
HETATM   28  H   UNL     1       2.287  -3.037   0.248  1.00  0.00           H  
HETATM   29  H   UNL     1       3.074  -2.312   1.670  1.00  0.00           H  
HETATM   30  H   UNL     1       1.298  -2.322   1.544  1.00  0.00           H  
HETATM   31  H   UNL     1       4.188   1.883  -2.205  1.00  0.00           H  
HETATM   32  H   UNL     1       3.368   3.050  -1.141  1.00  0.00           H  
HETATM   33  H   UNL     1       4.793   2.160  -0.554  1.00  0.00           H  
HETATM   34  H   UNL     1       1.117   1.666  -1.168  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.437  -1.610  -0.142  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.976  -1.891  -0.303  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.439   0.563   0.123  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.025   2.540   0.458  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.323   3.340   0.587  1.00  0.00           H  
CONECT    1    2   24   25   26                                       
CONECT    2    1    3   27                                            
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3    6    8    8                                       
CONECT    6    5    7   11   11                                       
CONECT    7    6   28   29   30                                       
CONECT    8    5    5    9   10                                       
CONECT    9    8   31   32   33                                       
CONECT   10    8   11   34                                            
CONECT   11    6    6   10   12                                       
CONECT   12   11   13   13   35                                       
CONECT   13   12   12   14   22                                       
CONECT   14   13   15   15   20                                       
CONECT   15   14   14   16   36                                       
CONECT   16   15   17   18   18                                       
CONECT   17   16                                                      
CONECT   18   16   16   19   37                                       
CONECT   19   18   20   20   38                                       
CONECT   20   14   19   19   21                                       
CONECT   21   20   22   39                                            
CONECT   22   13   21   23   23                                       
CONECT   23   22   22                                                 
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    7                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   15                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   21                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
