COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.435   0.289  -9.039  1.00  0.00           O  
HETATM    2  C   UNL     1       0.632  -0.842  -8.190  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.076  -0.618  -6.880  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.390  -1.023  -6.727  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.044  -0.819  -5.526  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.388  -0.209  -4.475  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.069   0.198  -4.625  1.00  0.00           C  
HETATM    8  N   UNL     1       0.598   0.816  -3.563  1.00  0.00           N  
HETATM    9  C   UNL     1       0.317   0.445  -2.262  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.505  -0.576  -2.051  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.805  -0.970  -0.828  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.235  -0.286   0.256  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.519  -0.662   1.589  1.00  0.00           C  
HETATM   14  C   UNL     1       0.061   0.037   2.613  1.00  0.00           C  
HETATM   15  C   UNL     1       0.958   1.152   2.304  1.00  0.00           C  
HETATM   16  O   UNL     1       1.479   1.779   3.209  1.00  0.00           O  
HETATM   17  N   UNL     1       1.210   1.488   1.025  1.00  0.00           N  
HETATM   18  C   UNL     1       0.629   0.797  -0.007  1.00  0.00           C  
HETATM   19  N   UNL     1       0.878   1.120  -1.271  1.00  0.00           N  
HETATM   20  C   UNL     1       2.110   2.607   0.732  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.215  -0.331   4.021  1.00  0.00           C  
HETATM   22  C   UNL     1       0.591  -1.265   4.673  1.00  0.00           C  
HETATM   23 CL   UNL     1       1.924  -1.997   3.835  1.00  0.00          Cl  
HETATM   24  C   UNL     1       0.328  -1.604   5.986  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.732  -1.020   6.654  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.536  -0.095   6.014  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.281   0.256   4.703  1.00  0.00           C  
HETATM   28 CL   UNL     1      -2.291   1.418   3.902  1.00  0.00          Cl  
HETATM   29  C   UNL     1       0.583  -0.002  -5.835  1.00  0.00           C  
HETATM   30  H   UNL     1       0.904   0.105  -9.864  1.00  0.00           H  
HETATM   31  H   UNL     1       1.698  -0.978  -8.008  1.00  0.00           H  
HETATM   32  H   UNL     1       0.230  -1.733  -8.673  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.905  -1.499  -7.548  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.070  -1.137  -5.410  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.900  -0.051  -3.537  1.00  0.00           H  
HETATM   36  H   UNL     1       1.257   1.505  -3.740  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.474  -1.802  -0.665  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.183  -1.487   1.797  1.00  0.00           H  
HETATM   39  H   UNL     1       2.471   3.036   1.667  1.00  0.00           H  
HETATM   40  H   UNL     1       2.956   2.249   0.146  1.00  0.00           H  
HETATM   41  H   UNL     1       1.572   3.367   0.167  1.00  0.00           H  
HETATM   42  H   UNL     1       0.952  -2.326   6.491  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.934  -1.289   7.681  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.364   0.355   6.542  1.00  0.00           H  
HETATM   45  H   UNL     1       1.609   0.313  -5.954  1.00  0.00           H  
CONECT    1    2   30                                                 
CONECT    2    1    3   31   32                                       
CONECT    3    2    4    4   29                                       
CONECT    4    3    3    5   33                                       
CONECT    5    4    6    6   34                                       
CONECT    6    5    5    7   35                                       
CONECT    7    6    8   29   29                                       
CONECT    8    7    9   36                                            
CONECT    9    8   10   10   19                                       
CONECT   10    9    9   11                                            
CONECT   11   10   12   12   37                                       
CONECT   12   11   11   13   18                                       
CONECT   13   12   14   14   38                                       
CONECT   14   13   13   15   21                                       
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   20                                            
CONECT   18   12   17   19   19                                       
CONECT   19    9   18   18                                            
CONECT   20   17   39   40   41                                       
CONECT   21   14   22   22   27                                       
CONECT   22   21   21   23   24                                       
CONECT   23   22                                                      
CONECT   24   22   25   25   42                                       
CONECT   25   24   24   26   43                                       
CONECT   26   25   27   27   44                                       
CONECT   27   21   26   26   28                                       
CONECT   28   27                                                      
CONECT   29    3    7    7   45                                       
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
CONECT   44   26                                                      
CONECT   45   29                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
