COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.996  -1.346   0.010  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.291  -0.665  -0.048  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.477  -0.893  -0.751  1.00  0.00           C  
HETATM    4 CL   UNL     1      -6.602  -2.243  -1.836  1.00  0.00          Cl  
HETATM    5  C   UNL     1      -7.546  -0.041  -0.579  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.450   1.039   0.288  1.00  0.00           C  
HETATM    7 CL   UNL     1      -8.808   2.101   0.493  1.00  0.00          Cl  
HETATM    8  C   UNL     1      -6.286   1.277   0.989  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.195   0.430   0.830  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.930   0.403   1.374  1.00  0.00           N  
HETATM   11  C   UNL     1      -3.230  -0.661   0.874  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.811  -1.013   1.240  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.884  -0.243   0.399  1.00  0.00           N  
HETATM   14  C   UNL     1       0.512  -0.560   0.728  1.00  0.00           C  
HETATM   15  C   UNL     1       1.445   0.259  -0.166  1.00  0.00           C  
HETATM   16  C   UNL     1       2.899  -0.072   0.176  1.00  0.00           C  
HETATM   17  N   UNL     1       3.793   0.712  -0.679  1.00  0.00           N  
HETATM   18  C   UNL     1       5.153   0.582  -0.553  1.00  0.00           C  
HETATM   19  N   UNL     1       5.619  -0.251   0.343  1.00  0.00           N  
HETATM   20  C   UNL     1       6.950  -0.428   0.521  1.00  0.00           C  
HETATM   21  C   UNL     1       7.448  -1.317   1.477  1.00  0.00           C  
HETATM   22  C   UNL     1       8.808  -1.467   1.626  1.00  0.00           C  
HETATM   23  C   UNL     1       9.694  -0.744   0.837  1.00  0.00           C  
HETATM   24  C   UNL     1       9.228   0.138  -0.112  1.00  0.00           C  
HETATM   25  C   UNL     1       7.855   0.305  -0.280  1.00  0.00           C  
HETATM   26  C   UNL     1       7.303   1.233  -1.277  1.00  0.00           C  
HETATM   27  O   UNL     1       8.031   1.892  -1.997  1.00  0.00           O  
HETATM   28  N   UNL     1       5.956   1.324  -1.370  1.00  0.00           N  
HETATM   29  H   UNL     1      -3.712  -2.234  -0.535  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.463  -0.215  -1.121  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.223   2.121   1.660  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.586   1.044   2.017  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.636  -0.772   2.288  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.648  -2.078   1.079  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.070  -0.400  -0.580  1.00  0.00           H  
HETATM   36  H   UNL     1       0.703  -0.317   1.773  1.00  0.00           H  
HETATM   37  H   UNL     1       0.691  -1.623   0.564  1.00  0.00           H  
HETATM   38  H   UNL     1       1.254   0.015  -1.211  1.00  0.00           H  
HETATM   39  H   UNL     1       1.266   1.321  -0.002  1.00  0.00           H  
HETATM   40  H   UNL     1       3.091   0.172   1.222  1.00  0.00           H  
HETATM   41  H   UNL     1       3.079  -1.135   0.013  1.00  0.00           H  
HETATM   42  H   UNL     1       3.423   1.323  -1.336  1.00  0.00           H  
HETATM   43  H   UNL     1       6.769  -1.884   2.097  1.00  0.00           H  
HETATM   44  H   UNL     1       9.191  -2.154   2.366  1.00  0.00           H  
HETATM   45  H   UNL     1      10.758  -0.876   0.970  1.00  0.00           H  
HETATM   46  H   UNL     1       9.922   0.696  -0.723  1.00  0.00           H  
HETATM   47  H   UNL     1       5.558   1.923  -2.020  1.00  0.00           H  
CONECT    1    2   11   11   29                                       
CONECT    2    1    3    3    9                                       
CONECT    3    4    2    2    5                                       
CONECT    4    3                                                      
CONECT    5    3    6    6   30                                       
CONECT    6    5    5    7    8                                       
CONECT    7    6                                                      
CONECT    8    6    9    9   31                                       
CONECT    9    2   10    8    8                                       
CONECT   10   11    9   32                                            
CONECT   11    1    1   10   12                                       
CONECT   12   11   13   33   34                                       
CONECT   13   12   14   35                                            
CONECT   14   13   15   36   37                                       
CONECT   15   14   16   38   39                                       
CONECT   16   15   17   40   41                                       
CONECT   17   16   18   42                                            
CONECT   18   17   19   19   28                                       
CONECT   19   18   18   20                                            
CONECT   20   19   21   21   25                                       
CONECT   21   20   20   22   43                                       
CONECT   22   21   23   23   44                                       
CONECT   23   22   22   24   45                                       
CONECT   24   25   25   23   46                                       
CONECT   25   20   26   24   24                                       
CONECT   26   28   25   27   27                                       
CONECT   27   26   26                                                 
CONECT   28   18   26   47                                            
CONECT   29    1                                                      
CONECT   30    5                                                      
CONECT   31    8                                                      
CONECT   32   10                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   28                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
