COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.933  -1.652  -0.138  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.991  -0.790  -0.133  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.780   0.576   0.084  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.922   1.506   0.090  1.00  0.00           C  
HETATM    5  O   UNL     1      -4.719   2.822   0.299  1.00  0.00           O  
HETATM    6  O   UNL     1      -6.048   1.087  -0.093  1.00  0.00           O  
HETATM    7  C   UNL     1      -2.483   1.059   0.296  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.425   0.197   0.291  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.637  -1.170   0.074  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.494  -2.100   0.068  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.554  -3.481   0.060  1.00  0.00           C  
HETATM   12  N   UNL     1       0.688  -3.950   0.057  1.00  0.00           N  
HETATM   13  C   UNL     1       1.546  -2.935   0.063  1.00  0.00           C  
HETATM   14  C   UNL     1       2.953  -2.885   0.063  1.00  0.00           C  
HETATM   15  C   UNL     1       3.576  -1.676   0.070  1.00  0.00           C  
HETATM   16  N   UNL     1       0.836  -1.765   0.064  1.00  0.00           N  
HETATM   17  N   UNL     1       1.505  -0.537   0.063  1.00  0.00           N  
HETATM   18  C   UNL     1       2.817  -0.491   0.077  1.00  0.00           C  
HETATM   19  N   UNL     1       3.463   0.741   0.084  1.00  0.00           N  
HETATM   20  CA  UNL     1       2.683   1.977   0.183  1.00  0.00           C  
HETATM   21  C   UNL     1       2.565   2.618  -1.201  1.00  0.00           C  
HETATM   22  C   UNL     1       1.751   1.704  -2.119  1.00  0.00           C  
HETATM   23  C   UNL     1       3.383   2.948   1.136  1.00  0.00           C  
HETATM   24  O   UNL     1       4.640   3.338   0.580  1.00  0.00           O  
HETATM   25  H   UNL     1      -3.097  -2.707  -0.301  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.992  -1.163  -0.297  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.320   2.113   0.463  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.425   0.569   0.454  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.455  -4.075   0.057  1.00  0.00           H  
HETATM   30  H   UNL     1       3.532  -3.797   0.058  1.00  0.00           H  
HETATM   31  H   UNL     1       4.655  -1.625   0.070  1.00  0.00           H  
HETATM   32  H   UNL     1       4.431   0.782   0.023  1.00  0.00           H  
HETATM   33  HA  UNL     1       1.687   1.749   0.564  1.00  0.00           H  
HETATM   34  H   UNL     1       2.065   3.583  -1.113  1.00  0.00           H  
HETATM   35  H   UNL     1       3.560   2.762  -1.621  1.00  0.00           H  
HETATM   36  H   UNL     1       1.597   2.197  -3.079  1.00  0.00           H  
HETATM   37  H   UNL     1       2.292   0.770  -2.273  1.00  0.00           H  
HETATM   38  H   UNL     1       0.786   1.493  -1.659  1.00  0.00           H  
HETATM   39  H1  UNL     1       2.759   3.830   1.280  1.00  0.00           H  
HETATM   40  H2  UNL     1       3.547   2.459   2.097  1.00  0.00           H  
HETATM   41  H   UNL     1       5.140   3.954   1.133  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.499   3.393   0.294  1.00  0.00           H  
CONECT    1    2    2    9   25                                       
CONECT    2    1    1    3   26                                       
CONECT    3    2    4    7    7                                       
CONECT    4    3    5    6    6                                       
CONECT    5    4   42                                                 
CONECT    6    4    4                                                 
CONECT    7    3    3    8   27                                       
CONECT    8    7    9    9   28                                       
CONECT    9    1    8    8   10                                       
CONECT   10    9   11   11   16                                       
CONECT   11   10   10   12   29                                       
CONECT   12   11   13   13                                            
CONECT   13   12   12   14   16                                       
CONECT   14   13   15   15   30                                       
CONECT   15   14   14   18   31                                       
CONECT   16   10   13   17                                            
CONECT   17   16   18   18                                            
CONECT   18   15   17   17   19                                       
CONECT   19   18   20   32                                            
CONECT   20   19   21   23   33                                       
CONECT   21   20   22   34   35                                       
CONECT   22   21   36   37   38                                       
CONECT   23   20   24   39   40                                       
CONECT   24   23   41                                                 
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29   11                                                      
CONECT   30   14                                                      
CONECT   31   15                                                      
CONECT   32   19                                                      
CONECT   33   20                                                      
CONECT   34   21                                                      
CONECT   35   21                                                      
CONECT   36   22                                                      
CONECT   37   22                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
CONECT   41   24                                                      
CONECT   42    5                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
