COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.983  -0.722   0.241  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.043   0.458   0.515  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.383   1.129   0.664  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.514   1.699   2.078  1.00  0.00           C  
HETATM    5  N   UNL     1      -3.448   0.151   0.431  1.00  0.00           N  
HETATM    6  C   UNL     1      -4.707   0.577  -0.001  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.950   1.928  -0.211  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.195   2.347  -0.638  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.717  -0.351  -0.228  1.00  0.00           C  
HETATM   10 CL   UNL     1      -5.417  -2.042   0.027  1.00  0.00          Cl  
HETATM   11  C   UNL     1      -6.961   0.075  -0.655  1.00  0.00           C  
HETATM   12 CL   UNL     1      -8.224  -1.082  -0.938  1.00  0.00          Cl  
HETATM   13  C   UNL     1      -7.200   1.423  -0.857  1.00  0.00           C  
HETATM   14  N   UNL     1       0.090   1.167   0.691  1.00  0.00           N  
HETATM   15  C   UNL     1       1.332   0.521   0.667  1.00  0.00           C  
HETATM   16  C   UNL     1       2.441   1.178   0.166  1.00  0.00           C  
HETATM   17  C   UNL     1       3.678   0.529   0.145  1.00  0.00           C  
HETATM   18  N   UNL     1       4.918   0.892  -0.271  1.00  0.00           N  
HETATM   19  C   UNL     1       5.740  -0.105  -0.064  1.00  0.00           C  
HETATM   20  O   UNL     1       5.079  -1.142   0.485  1.00  0.00           O  
HETATM   21  C   UNL     1       3.784  -0.784   0.633  1.00  0.00           C  
HETATM   22  C   UNL     1       2.662  -1.429   1.132  1.00  0.00           C  
HETATM   23  C   UNL     1       1.447  -0.780   1.154  1.00  0.00           C  
HETATM   24  C   UNL     1       7.183  -0.095  -0.389  1.00  0.00           C  
HETATM   25  C   UNL     1       7.785   1.034  -0.956  1.00  0.00           C  
HETATM   26  C   UNL     1       9.134   1.000  -1.242  1.00  0.00           C  
HETATM   27  N   UNL     1       9.854  -0.076  -0.988  1.00  0.00           N  
HETATM   28  C   UNL     1       9.326  -1.161  -0.454  1.00  0.00           C  
HETATM   29  C   UNL     1       7.985  -1.212  -0.131  1.00  0.00           C  
HETATM   30  H   UNL     1      -2.468   1.938  -0.062  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.430   0.891   2.804  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.722   2.427   2.251  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.484   2.184   2.186  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.280  -0.794   0.577  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.166   2.651  -0.039  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.384   3.398  -0.801  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.172   1.754  -1.191  1.00  0.00           H  
HETATM   38  H   UNL     1       0.044   2.125   0.834  1.00  0.00           H  
HETATM   39  H   UNL     1       2.350   2.187  -0.207  1.00  0.00           H  
HETATM   40  H   UNL     1       2.742  -2.439   1.507  1.00  0.00           H  
HETATM   41  H   UNL     1       0.576  -1.284   1.548  1.00  0.00           H  
HETATM   42  H   UNL     1       7.202   1.918  -1.167  1.00  0.00           H  
HETATM   43  H   UNL     1       9.608   1.866  -1.679  1.00  0.00           H  
HETATM   44  H   UNL     1       9.953  -2.020  -0.264  1.00  0.00           H  
HETATM   45  H   UNL     1       7.561  -2.102   0.309  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   14                                       
CONECT    3    4    5    2   30                                       
CONECT    4    3   31   32   33                                       
CONECT    5    3    6   34                                            
CONECT    6    5    9    9    7                                       
CONECT    7    6    8    8   35                                       
CONECT    8    7    7   13   36                                       
CONECT    9   10    6    6   11                                       
CONECT   10    9                                                      
CONECT   11   12    9   13   13                                       
CONECT   12   11                                                      
CONECT   13   11   11    8   37                                       
CONECT   14    2   15   38                                            
CONECT   15   14   16   16   23                                       
CONECT   16   15   15   17   39                                       
CONECT   17   16   21   21   18                                       
CONECT   18   17   19   19                                            
CONECT   19   18   18   20   24                                       
CONECT   20   21   19                                                 
CONECT   21   17   17   22   20                                       
CONECT   22   23   23   21   40                                       
CONECT   23   15   22   22   41                                       
CONECT   24   19   25   25   29                                       
CONECT   25   24   24   26   42                                       
CONECT   26   25   27   27   43                                       
CONECT   27   26   26   28                                            
CONECT   28   29   29   27   44                                       
CONECT   29   24   28   28   45                                       
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   16                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   25                                                      
CONECT   43   26                                                      
CONECT   44   28                                                      
CONECT   45   29                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
