COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.286   2.644   0.467  1.00  0.00           C  
HETATM    2  N   UNL     1      -4.467   1.197   0.615  1.00  0.00           N  
HETATM    3  C   UNL     1      -3.429   0.333   0.303  1.00  0.00           C  
HETATM    4  N   UNL     1      -3.584  -0.982   0.434  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.597  -1.814   0.138  1.00  0.00           C  
HETATM    6  N   UNL     1      -2.796  -3.176   0.287  1.00  0.00           N  
HETATM    7  N   UNL     1      -1.425  -1.378  -0.299  1.00  0.00           N  
HETATM    8  C   UNL     1      -1.198  -0.076  -0.455  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.213   0.829  -0.157  1.00  0.00           C  
HETATM   10  N   UNL     1       0.031   0.373  -0.912  1.00  0.00           N  
HETATM   11  C   UNL     1       0.628   1.327   0.033  1.00  0.00           C  
HETATM   12  C   UNL     1       1.943   1.858  -0.544  1.00  0.00           C  
HETATM   13  N   UNL     1       2.853   0.732  -0.797  1.00  0.00           N  
HETATM   14  C   UNL     1       2.256  -0.222  -1.742  1.00  0.00           C  
HETATM   15  C   UNL     1       0.942  -0.753  -1.165  1.00  0.00           C  
HETATM   16  C   UNL     1       3.228   0.066   0.457  1.00  0.00           C  
HETATM   17  C   UNL     1       4.265  -1.053   0.300  1.00  0.00           C  
HETATM   18  O   UNL     1       4.892  -0.588   1.502  1.00  0.00           O  
HETATM   19  C   UNL     1       4.395   0.724   1.204  1.00  0.00           C  
HETATM   20  H   UNL     1      -3.467   2.974   1.105  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.053   2.876  -0.572  1.00  0.00           H  
HETATM   22  H   UNL     1      -5.203   3.156   0.757  1.00  0.00           H  
HETATM   23  H   UNL     1      -5.313   0.844   0.932  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.649  -3.509   0.606  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.082  -3.796   0.074  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.059   1.891  -0.278  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.059   2.157   0.194  1.00  0.00           H  
HETATM   28  H   UNL     1       0.823   0.826   0.981  1.00  0.00           H  
HETATM   29  H   UNL     1       1.744   2.382  -1.479  1.00  0.00           H  
HETATM   30  H   UNL     1       2.402   2.544   0.168  1.00  0.00           H  
HETATM   31  H   UNL     1       2.061   0.279  -2.690  1.00  0.00           H  
HETATM   32  H   UNL     1       2.944  -1.052  -1.903  1.00  0.00           H  
HETATM   33  H   UNL     1       1.140  -1.277  -0.230  1.00  0.00           H  
HETATM   34  H   UNL     1       0.483  -1.439  -1.877  1.00  0.00           H  
HETATM   35  H   UNL     1       2.376  -0.191   1.086  1.00  0.00           H  
HETATM   36  H   UNL     1       3.841  -2.053   0.392  1.00  0.00           H  
HETATM   37  H   UNL     1       4.890  -0.941  -0.586  1.00  0.00           H  
HETATM   38  H   UNL     1       5.055   1.300   0.555  1.00  0.00           H  
HETATM   39  H   UNL     1       4.085   1.280   2.089  1.00  0.00           H  
CONECT    1    2   20   21   22                                       
CONECT    2    1    3   23                                            
CONECT    3    2    9    9    4                                       
CONECT    4    3    5    5                                            
CONECT    5    4    4    7    6                                       
CONECT    6    5   24   25                                            
CONECT    7    8    8    5                                            
CONECT    8    9   10    7    7                                       
CONECT    9    3    3    8   26                                       
CONECT   10   11    8   15                                            
CONECT   11   12   10   27   28                                       
CONECT   12   11   13   29   30                                       
CONECT   13   12   16   14                                            
CONECT   14   13   15   31   32                                       
CONECT   15   10   14   33   34                                       
CONECT   16   17   19   13   35                                       
CONECT   17   18   16   36   37                                       
CONECT   18   17   19                                                 
CONECT   19   18   16   38   39                                       
CONECT   20    1                                                      
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    6                                                      
CONECT   25    6                                                      
CONECT   26    9                                                      
CONECT   27   11                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   12                                                      
CONECT   31   14                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   17                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
