COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.604   0.745  -1.920  1.00  0.00           C  
HETATM    2  C   UNL     1       2.736   0.362  -0.444  1.00  0.00           C  
HETATM    3  C   UNL     1       4.144   0.628   0.020  1.00  0.00           C  
HETATM    4  C   UNL     1       4.431   1.776   0.734  1.00  0.00           C  
HETATM    5  C   UNL     1       5.723   2.021   1.160  1.00  0.00           C  
HETATM    6  C   UNL     1       6.729   1.117   0.871  1.00  0.00           C  
HETATM    7  C   UNL     1       6.442  -0.031   0.156  1.00  0.00           C  
HETATM    8  C   UNL     1       5.149  -0.278  -0.264  1.00  0.00           C  
HETATM    9  N   UNL     1       2.428  -1.061  -0.280  1.00  0.00           N  
HETATM   10  C   UNL     1       1.108  -1.475  -0.132  1.00  0.00           C  
HETATM   11  C   UNL     1       0.812  -2.837   0.026  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.446  -3.228   0.167  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.423  -2.336   0.159  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.134  -0.985   0.003  1.00  0.00           C  
HETATM   15  N   UNL     1       0.130  -0.585  -0.133  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.232   0.011  -0.005  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.551  -0.405   0.143  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.578   0.538   0.134  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.277   1.894  -0.023  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.967   2.299  -0.169  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.944   1.369  -0.156  1.00  0.00           C  
HETATM   22 CL   UNL     1      -0.298   1.889  -0.340  1.00  0.00          Cl  
HETATM   23  C   UNL     1      -5.982   0.105   0.290  1.00  0.00           C  
HETATM   24  O   UNL     1      -6.973   1.017   0.282  1.00  0.00           O  
HETATM   25  O   UNL     1      -6.242  -1.074   0.426  1.00  0.00           O  
HETATM   26  N   UNL     1       1.838  -3.776   0.034  1.00  0.00           N  
HETATM   27  H   UNL     1       3.300   0.152  -2.513  1.00  0.00           H  
HETATM   28  H   UNL     1       1.585   0.552  -2.256  1.00  0.00           H  
HETATM   29  H   UNL     1       2.833   1.803  -2.042  1.00  0.00           H  
HETATM   30  H   UNL     1       2.039   0.955   0.149  1.00  0.00           H  
HETATM   31  H   UNL     1       3.646   2.482   0.960  1.00  0.00           H  
HETATM   32  H   UNL     1       5.948   2.918   1.718  1.00  0.00           H  
HETATM   33  H   UNL     1       7.739   1.309   1.203  1.00  0.00           H  
HETATM   34  H   UNL     1       7.227  -0.739  -0.065  1.00  0.00           H  
HETATM   35  H   UNL     1       4.925  -1.175  -0.822  1.00  0.00           H  
HETATM   36  H   UNL     1       3.145  -1.715  -0.274  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.447  -2.659   0.274  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.779  -1.454   0.263  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.072   2.625  -0.030  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.739   3.348  -0.290  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.876   0.686   0.387  1.00  0.00           H  
HETATM   42  H   UNL     1       2.759  -3.490  -0.070  1.00  0.00           H  
HETATM   43  H   UNL     1       1.633  -4.718   0.143  1.00  0.00           H  
CONECT    1    2   27   28   29                                       
CONECT    2    1    3    9   30                                       
CONECT    3    8    2    4    4                                       
CONECT    4    3    3    5   31                                       
CONECT    5    6    6    4   32                                       
CONECT    6    7    5    5   33                                       
CONECT    7    8    8    6   34                                       
CONECT    8    7    7    3   35                                       
CONECT    9    2   10   36                                            
CONECT   10   15    9   11   11                                       
CONECT   11   10   10   12   26                                       
CONECT   12   13   13   11                                            
CONECT   13   14   12   12   37                                       
CONECT   14   16   15   15   13                                       
CONECT   15   14   14   10                                            
CONECT   16   21   21   17   14                                       
CONECT   17   18   18   16   38                                       
CONECT   18   19   23   17   17                                       
CONECT   19   20   20   18   39                                       
CONECT   20   19   19   21   40                                       
CONECT   21   20   22   16   16                                       
CONECT   22   21                                                      
CONECT   23   25   25   18   24                                       
CONECT   24   23   41                                                 
CONECT   25   23   23                                                 
CONECT   26   11   42   43                                            
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   13                                                      
CONECT   38   17                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   24                                                      
CONECT   42   26                                                      
CONECT   43   26                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
