COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.316   1.041  -0.254  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.805   1.298   0.428  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.900   0.278  -0.271  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.424  -1.133   0.009  1.00  0.00           C  
HETATM    5  O   UNL     1      -3.777  -1.235  -0.440  1.00  0.00           O  
HETATM    6  C   UNL     1      -4.677  -0.338   0.212  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.244   1.105  -0.059  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.533   0.404   0.242  1.00  0.00           N  
HETATM    9  O   UNL     1      -5.109   2.003   0.640  1.00  0.00           O  
HETATM   10  O   UNL     1      -2.365   2.621   0.114  1.00  0.00           O  
HETATM   11  C   UNL     1      -6.093  -0.555  -0.326  1.00  0.00           C  
HETATM   12  O   UNL     1      -2.367  -1.393   1.413  1.00  0.00           O  
HETATM   13  O   UNL     1      -6.541  -1.865   0.029  1.00  0.00           O  
HETATM   14  C   UNL     1       0.510   0.013  -0.517  1.00  0.00           C  
HETATM   15  C   UNL     1       1.915   0.142   0.011  1.00  0.00           C  
HETATM   16  O   UNL     1       0.317  -0.442  -1.624  1.00  0.00           O  
HETATM   17  C   UNL     1       2.903  -0.369  -1.040  1.00  0.00           C  
HETATM   18  C   UNL     1       4.309  -0.240  -0.512  1.00  0.00           C  
HETATM   19  C   UNL     1       4.879  -1.282   0.195  1.00  0.00           C  
HETATM   20  C   UNL     1       6.163  -1.162   0.690  1.00  0.00           C  
HETATM   21  C   UNL     1       6.887  -0.001   0.461  1.00  0.00           C  
HETATM   22  C   UNL     1       5.027   0.921  -0.737  1.00  0.00           C  
HETATM   23  O   UNL     1       8.155   0.115   0.937  1.00  0.00           O  
HETATM   24  H   UNL     1       6.876   1.948  -0.430  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.761   1.146   1.506  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.904   0.463  -1.345  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.809  -1.860  -0.521  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.663  -0.526   1.286  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.298   1.307  -1.129  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.379   0.768   1.128  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.039   1.932   0.384  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.896   3.319   0.522  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.764   0.188   0.106  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.089  -0.453  -1.411  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.684  -2.271   1.663  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.434  -2.072  -0.281  1.00  0.00           H  
HETATM   37  H   UNL     1       2.127   1.189   0.230  1.00  0.00           H  
HETATM   38  H   UNL     1       2.017  -0.448   0.922  1.00  0.00           H  
HETATM   39  H   UNL     1       2.692  -1.415  -1.259  1.00  0.00           H  
HETATM   40  H   UNL     1       2.802   0.221  -1.951  1.00  0.00           H  
HETATM   41  H   UNL     1       4.316  -2.187   0.369  1.00  0.00           H  
HETATM   42  H   UNL     1       6.608  -1.976   1.243  1.00  0.00           H  
HETATM   43  H   UNL     1       4.579   1.733  -1.290  1.00  0.00           H  
HETATM   44  H   UNL     1       8.835  -0.195   0.323  1.00  0.00           H  
CONECT    1   21   22   22   24                                       
CONECT    2    7    3   10   25                                       
CONECT    3    4    2    8   26                                       
CONECT    4    5    3   12   27                                       
CONECT    5    6    4                                                 
CONECT    6   11    5    7   28                                       
CONECT    7    6    9    2   29                                       
CONECT    8    3   14   30                                            
CONECT    9    7   31                                                 
CONECT   10    2   32                                                 
CONECT   11   13    6   33   34                                       
CONECT   12    4   35                                                 
CONECT   13   11   36                                                 
CONECT   14   16   16    8   15                                       
CONECT   15   14   17   37   38                                       
CONECT   16   14   14                                                 
CONECT   17   18   15   39   40                                       
CONECT   18   19   19   22   17                                       
CONECT   19   20   18   18   41                                       
CONECT   20   21   21   19   42                                       
CONECT   21   23   20   20    1                                       
CONECT   22    1    1   18   43                                       
CONECT   23   21   44                                                 
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
