COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.340   3.484   0.311  1.00  0.00           C  
HETATM    2  O   UNL     1      -0.554   4.304   0.241  1.00  0.00           O  
HETATM    3  O   UNL     1       1.597   3.879   0.591  1.00  0.00           O  
HETATM    4  C   UNL     1       0.047   2.056   0.095  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.200   1.699  -0.173  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.592   0.267  -0.416  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.494  -0.660   0.116  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.709  -2.019  -0.386  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.544  -2.854   0.263  1.00  0.00           C  
HETATM   10  O   UNL     1      -2.119  -2.479   1.263  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.765  -4.252  -0.254  1.00  0.00           C  
HETATM   12  C   UNL     1       0.860  -0.134  -0.377  1.00  0.00           C  
HETATM   13  O   UNL     1       1.068   1.168   0.176  1.00  0.00           O  
HETATM   14  C   UNL     1       1.977  -1.074   0.081  1.00  0.00           C  
HETATM   15  O   UNL     1       1.913  -1.234   1.499  1.00  0.00           O  
HETATM   16  C   UNL     1       3.333  -0.481  -0.305  1.00  0.00           C  
HETATM   17  O   UNL     1       3.397  -0.322  -1.724  1.00  0.00           O  
HETATM   18  C   UNL     1       4.450  -1.422   0.153  1.00  0.00           C  
HETATM   19  O   UNL     1       5.719  -0.816  -0.103  1.00  0.00           O  
HETATM   20  N   UNL     1      -2.851  -0.019   0.276  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.050   0.274  -0.329  1.00  0.00           C  
HETATM   22  N   UNL     1      -4.067   0.806  -1.519  1.00  0.00           N  
HETATM   23  N   UNL     1      -5.232   0.005   0.320  1.00  0.00           N  
HETATM   24  H   UNL     1      -1.962   2.463  -0.218  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.720   0.102  -1.486  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.513  -0.664   1.206  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.249  -2.319  -1.186  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.169  -4.405  -1.154  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.465  -4.972   0.507  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.820  -4.390  -0.489  1.00  0.00           H  
HETATM   31  H   UNL     1       0.856  -0.070  -1.465  1.00  0.00           H  
HETATM   32  H   UNL     1       1.854  -2.045  -0.400  1.00  0.00           H  
HETATM   33  H   UNL     1       2.015  -0.409   1.993  1.00  0.00           H  
HETATM   34  H   UNL     1       3.456   0.489   0.176  1.00  0.00           H  
HETATM   35  H   UNL     1       3.296  -1.147  -2.218  1.00  0.00           H  
HETATM   36  H   UNL     1       4.348  -1.615   1.221  1.00  0.00           H  
HETATM   37  H   UNL     1       4.380  -2.362  -0.394  1.00  0.00           H  
HETATM   38  H   UNL     1       6.474  -1.357   0.163  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.913   1.013  -1.946  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.219  -0.391   1.206  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.078   0.212  -0.107  1.00  0.00           H  
HETATM   42  H   UNL     1       1.739   4.826   0.729  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.839  -0.415   1.161  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   42                                                 
CONECT    4    1    5    5   13                                       
CONECT    5    4    4    6   24                                       
CONECT    6    5    7   20   25                                       
CONECT    7    6    8   12   26                                       
CONECT    8    7    9   27                                            
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   28   29   30                                       
CONECT   12    7   13   14   31                                       
CONECT   13    4   12                                                 
CONECT   14   12   15   16   32                                       
CONECT   15   14   33                                                 
CONECT   16   14   17   18   34                                       
CONECT   17   16   35                                                 
CONECT   18   16   19   36   37                                       
CONECT   19   18   38                                                 
CONECT   20    6   21   43                                            
CONECT   21   20   22   22   23                                       
CONECT   22   21   21   39                                            
CONECT   23   21   40   41                                            
CONECT   24    5                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28   11                                                      
CONECT   29   11                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42    3                                                      
CONECT   43   20                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
