COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.403  -0.211   0.478  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.171  -1.527   0.873  1.00  0.00           C  
HETATM    3  C   UNL     1       1.112  -2.029   0.909  1.00  0.00           C  
HETATM    4  C   UNL     1       0.651   0.607   0.119  1.00  0.00           C  
HETATM    5  C   UNL     1       1.957   0.109   0.152  1.00  0.00           C  
HETATM    6  N   UNL     1       3.166   0.651  -0.135  1.00  0.00           N  
HETATM    7  C   UNL     1       5.552  -0.012  -0.152  1.00  0.00           C  
HETATM    8  C   UNL     1       7.359   1.441  -0.779  1.00  0.00           C  
HETATM    9  C   UNL     1       7.815  -0.815  -0.099  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.235  -0.698  -0.366  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.871   2.929  -0.422  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.736  -0.541   0.140  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.712   0.283   0.440  1.00  0.00           N  
HETATM   14  O   UNL     1      -2.529  -1.726  -0.044  1.00  0.00           O  
HETATM   15  C   UNL     1       2.182  -1.220   0.551  1.00  0.00           C  
HETATM   16  N   UNL     1       3.550  -1.416   0.484  1.00  0.00           N  
HETATM   17  C   UNL     1       4.106  -0.241   0.057  1.00  0.00           C  
HETATM   18  C   UNL     1       6.008   1.232  -0.591  1.00  0.00           C  
HETATM   19  C   UNL     1       8.261   0.421  -0.533  1.00  0.00           C  
HETATM   20  C   UNL     1       6.467  -1.037   0.093  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.102  -0.009   0.034  1.00  0.00           C  
HETATM   22  N   UNL     1      -5.773   1.370   0.103  1.00  0.00           N  
HETATM   23  N   UNL     1      -4.509   1.267   0.309  1.00  0.00           N  
HETATM   24  C   UNL     1      -6.276   0.233  -0.303  1.00  0.00           C  
HETATM   25 CL   UNL     1      -5.339  -2.362  -0.850  1.00  0.00          Cl  
HETATM   26  C   UNL     1      -3.638   2.351   0.769  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.960   4.062   0.058  1.00  0.00           C  
HETATM   28  H   UNL     1      -1.001  -2.158   1.152  1.00  0.00           H  
HETATM   29  H   UNL     1       1.286  -3.049   1.217  1.00  0.00           H  
HETATM   30  H   UNL     1       0.467   1.626  -0.187  1.00  0.00           H  
HETATM   31  H   UNL     1       7.713   2.403  -1.118  1.00  0.00           H  
HETATM   32  H   UNL     1       8.524  -1.607   0.090  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.266   2.146  -0.879  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.577   3.318  -1.155  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.883   1.219   0.630  1.00  0.00           H  
HETATM   36  H   UNL     1       4.025  -2.234   0.698  1.00  0.00           H  
HETATM   37  H   UNL     1       5.305   2.029  -0.783  1.00  0.00           H  
HETATM   38  H   UNL     1       9.317   0.589  -0.682  1.00  0.00           H  
HETATM   39  H   UNL     1       6.120  -2.002   0.433  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.311   0.047  -0.550  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.931   1.963   1.502  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.242   3.135   1.227  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.565   4.845   0.516  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.254   3.673   0.792  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.414   4.473  -0.790  1.00  0.00           H  
CONECT    1   13    2    2    4                                       
CONECT    2    1    1    3   28                                       
CONECT    3    2   15   15   29                                       
CONECT    4    1    5    5   30                                       
CONECT    5    4    4   15    6                                       
CONECT    6    5   17   17                                            
CONECT    7   17   18   18   20                                       
CONECT    8   18   19   19   31                                       
CONECT    9   19   20   20   32                                       
CONECT   10   21   21   24   25                                       
CONECT   11   26   27   33   34                                       
CONECT   12   13   14   14   21                                       
CONECT   13   12    1   35                                            
CONECT   14   12   12                                                 
CONECT   15    3    3    5   16                                       
CONECT   16   15   17   36                                            
CONECT   17   16    6    6    7                                       
CONECT   18    7    7    8   37                                       
CONECT   19    8    8    9   38                                       
CONECT   20    7    9    9   39                                       
CONECT   21   12   23   10   10                                       
CONECT   22   23   24   24                                            
CONECT   23   21   22   26                                            
CONECT   24   22   22   10   40                                       
CONECT   25   10                                                      
CONECT   26   23   11   41   42                                       
CONECT   27   11   43   44   45                                       
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   13                                                      
CONECT   36   16                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   24                                                      
CONECT   41   26                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
CONECT   44   27                                                      
CONECT   45   27                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
