COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.808  -2.997   0.853  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.649  -1.845   0.498  1.00  0.00           C  
HETATM    3  N   UNL     1      -4.739  -1.137   0.249  1.00  0.00           N  
HETATM    4  C   UNL     1      -4.801   0.185  -0.188  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.749   0.538  -1.142  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.857   1.848  -1.566  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.024   2.819  -1.041  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.070   2.477  -0.102  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.944   1.159   0.315  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.914   0.819   1.202  1.00  0.00           N  
HETATM   11  C   UNL     1      -2.268  -1.364   0.391  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.926  -0.065   0.787  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.604   0.348   0.740  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.273  -2.213  -0.109  1.00  0.00           C  
HETATM   15  C   UNL     1       0.033  -1.786  -0.173  1.00  0.00           C  
HETATM   16  C   UNL     1       0.378  -0.515   0.260  1.00  0.00           C  
HETATM   17  C   UNL     1       1.792  -0.074   0.208  1.00  0.00           C  
HETATM   18  C   UNL     1       2.772  -0.934  -0.282  1.00  0.00           C  
HETATM   19  C   UNL     1       2.139   1.207   0.644  1.00  0.00           C  
HETATM   20  C   UNL     1       3.439   1.622   0.599  1.00  0.00           C  
HETATM   21  C   UNL     1       4.433   0.766   0.115  1.00  0.00           C  
HETATM   22  C   UNL     1       5.836   1.215   0.068  1.00  0.00           C  
HETATM   23  O   UNL     1       6.161   2.453   0.492  1.00  0.00           O  
HETATM   24  O   UNL     1       6.699   0.471  -0.353  1.00  0.00           O  
HETATM   25  C   UNL     1       4.092  -0.520  -0.331  1.00  0.00           C  
HETATM   26  O   UNL     1       5.051  -1.354  -0.806  1.00  0.00           O  
HETATM   27  C   UNL     1       4.628  -2.647  -1.242  1.00  0.00           C  
HETATM   28  H   UNL     1      -5.587  -1.587   0.384  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.403  -0.216  -1.554  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.593   2.115  -2.309  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.120   3.845  -1.365  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.421   3.236   0.309  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.892   1.196   2.096  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.335   1.339   1.075  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.532  -3.206  -0.445  1.00  0.00           H  
HETATM   36  H   UNL     1       0.795  -2.444  -0.562  1.00  0.00           H  
HETATM   37  H   UNL     1       2.502  -1.923  -0.624  1.00  0.00           H  
HETATM   38  H   UNL     1       1.375   1.872   1.019  1.00  0.00           H  
HETATM   39  H   UNL     1       3.700   2.613   0.938  1.00  0.00           H  
HETATM   40  H   UNL     1       7.094   2.703   0.442  1.00  0.00           H  
HETATM   41  H   UNL     1       4.166  -3.178  -0.410  1.00  0.00           H  
HETATM   42  H   UNL     1       3.905  -2.540  -2.051  1.00  0.00           H  
HETATM   43  H   UNL     1       5.491  -3.211  -1.597  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   11                                       
CONECT    3    4    2   28                                            
CONECT    4    5    3    9    9                                       
CONECT    5    6    6    4   29                                       
CONECT    6    5    5    7   30                                       
CONECT    7    6    8    8   31                                       
CONECT    8    7    7    9   32                                       
CONECT    9    4    4    8   10                                       
CONECT   10    9   12   33                                            
CONECT   11    2   14   14   12                                       
CONECT   12   11   10   13   13                                       
CONECT   13   12   12   16   34                                       
CONECT   14   11   11   15   35                                       
CONECT   15   14   16   16   36                                       
CONECT   16   15   15   13   17                                       
CONECT   17   16   19   19   18                                       
CONECT   18   17   25   25   37                                       
CONECT   19   17   17   20   38                                       
CONECT   20   19   21   21   39                                       
CONECT   21   20   20   25   22                                       
CONECT   22   21   24   24   23                                       
CONECT   23   22   40                                                 
CONECT   24   22   22                                                 
CONECT   25   18   18   21   26                                       
CONECT   26   27   25                                                 
CONECT   27   26   41   42   43                                       
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   10                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   23                                                      
CONECT   41   27                                                      
CONECT   42   27                                                      
CONECT   43   27                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
