COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  O   UNL     1       4.025   1.287   8.164  1.00  0.00           O  
HETATM    2  C   UNL     1       3.255   1.075   9.097  1.00  0.00           C  
HETATM    3  N   UNL     1       3.514   1.447  10.399  1.00  0.00           N  
HETATM    4  C   UNL     1       1.914   0.378   8.941  1.00  0.00           C  
HETATM    5  C   UNL     1       1.640  -0.098   7.554  1.00  0.00           C  
HETATM    6  C   UNL     1       0.991   0.739   6.646  1.00  0.00           C  
HETATM    7  C   UNL     1       0.734   0.294   5.349  1.00  0.00           C  
HETATM    8  C   UNL     1       1.128  -0.985   4.968  1.00  0.00           C  
HETATM    9  C   UNL     1       1.775  -1.824   5.869  1.00  0.00           C  
HETATM   10  C   UNL     1       2.032  -1.379   7.166  1.00  0.00           C  
HETATM   11  O   UNL     1       0.874  -1.422   3.695  1.00  0.00           O  
HETATM   12  C   UNL     1       0.842  -0.431   2.673  1.00  0.00           C  
HETATM   13  C   UNL     1       1.310  -1.058   1.363  1.00  0.00           C  
HETATM   14  O   UNL     1       0.420  -2.122   1.025  1.00  0.00           O  
HETATM   15  C   UNL     1       2.743  -1.588   1.426  1.00  0.00           C  
HETATM   16  N   UNL     1       3.679  -0.532   1.737  1.00  0.00           N  
HETATM   17  C   UNL     1       5.051  -1.032   1.776  1.00  0.00           C  
HETATM   18  C   UNL     1       5.153  -2.129   2.826  1.00  0.00           C  
HETATM   19  C   UNL     1       5.990   0.127   2.080  1.00  0.00           C  
HETATM   20  H   UNL     1       2.833   1.241  11.123  1.00  0.00           H  
HETATM   21  H   UNL     1       4.376   1.923  10.644  1.00  0.00           H  
HETATM   22  H   UNL     1       1.127   1.076   9.271  1.00  0.00           H  
HETATM   23  H   UNL     1       1.882  -0.467   9.649  1.00  0.00           H  
HETATM   24  H   UNL     1       0.682   1.738   6.939  1.00  0.00           H  
HETATM   25  H   UNL     1       0.228   0.950   4.646  1.00  0.00           H  
HETATM   26  H   UNL     1       2.082  -2.823   5.572  1.00  0.00           H  
HETATM   27  H   UNL     1       2.538  -2.037   7.867  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.186  -0.065   2.588  1.00  0.00           H  
HETATM   29  H   UNL     1       1.500   0.387   2.985  1.00  0.00           H  
HETATM   30  H   UNL     1       1.233  -0.318   0.559  1.00  0.00           H  
HETATM   31  H   UNL     1       0.465  -2.221   0.063  1.00  0.00           H  
HETATM   32  H   UNL     1       2.824  -2.356   2.202  1.00  0.00           H  
HETATM   33  H   UNL     1       3.021  -2.045   0.471  1.00  0.00           H  
HETATM   34  H   UNL     1       3.619   0.205   1.029  1.00  0.00           H  
HETATM   35  H   UNL     1       5.289  -1.445   0.790  1.00  0.00           H  
HETATM   36  H   UNL     1       6.168  -2.536   2.867  1.00  0.00           H  
HETATM   37  H   UNL     1       4.894  -1.754   3.823  1.00  0.00           H  
HETATM   38  H   UNL     1       4.466  -2.951   2.596  1.00  0.00           H  
HETATM   39  H   UNL     1       5.898   0.911   1.320  1.00  0.00           H  
HETATM   40  H   UNL     1       7.032  -0.209   2.097  1.00  0.00           H  
HETATM   41  H   UNL     1       5.762   0.582   3.051  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   20   21                                            
CONECT    4    2    5   22   23                                       
CONECT    5    4   10   10    6                                       
CONECT    6    5    7    7   24                                       
CONECT    7    6    6    8   25                                       
CONECT    8    7    9    9   11                                       
CONECT    9    8    8   10   26                                       
CONECT   10    5    5    9   27                                       
CONECT   11    8   12                                                 
CONECT   12   11   13   28   29                                       
CONECT   13   12   15   14   30                                       
CONECT   14   13   31                                                 
CONECT   15   13   16   32   33                                       
CONECT   16   15   17   34                                            
CONECT   17   16   18   19   35                                       
CONECT   18   17   36   37   38                                       
CONECT   19   17   39   40   41                                       
CONECT   20    3                                                      
CONECT   21    3                                                      
CONECT   22    4                                                      
CONECT   23    4                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    9                                                      
CONECT   27   10                                                      
CONECT   28   12                                                      
CONECT   29   12                                                      
CONECT   30   13                                                      
CONECT   31   14                                                      
CONECT   32   15                                                      
CONECT   33   15                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
