COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.450   0.355  -0.760  1.00  0.00           C  
HETATM    2  N   UNL     1      -5.617   1.377  -1.166  1.00  0.00           N  
HETATM    3  O   UNL     1      -3.879  -0.627  -1.328  1.00  0.00           O  
HETATM    4  N   UNL     1       5.427   2.045   0.276  1.00  0.00           N  
HETATM    5  C   UNL     1       4.216   2.545   0.442  1.00  0.00           C  
HETATM    6  N   UNL     1       3.134   1.796   0.429  1.00  0.00           N  
HETATM    7  C   UNL     1       3.222   0.482   0.247  1.00  0.00           C  
HETATM    8  C   UNL     1       4.488  -0.099   0.065  1.00  0.00           C  
HETATM    9  C   UNL     1       5.614   0.743   0.086  1.00  0.00           C  
HETATM   10  N   UNL     1       6.886   0.228  -0.087  1.00  0.00           N  
HETATM   11  N   UNL     1       4.297  -1.430  -0.097  1.00  0.00           N  
HETATM   12  C   UNL     1       3.025  -1.697  -0.028  1.00  0.00           C  
HETATM   13  N   UNL     1      -2.135   0.454  -0.484  1.00  0.00           N  
HETATM   14  N   UNL     1       2.320  -0.549   0.183  1.00  0.00           N  
HETATM   15  C   UNL     1      -4.388   1.467  -0.367  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.734   1.341   1.118  1.00  0.00           C  
HETATM   17  O   UNL     1      -5.258   0.037   1.376  1.00  0.00           O  
HETATM   18  C   UNL     1       0.865  -0.439   0.317  1.00  0.00           C  
HETATM   19  C   UNL     1       0.217  -0.082  -1.045  1.00  0.00           C  
HETATM   20  O   UNL     1       0.207   1.333  -1.250  1.00  0.00           O  
HETATM   21  C   UNL     1      -1.222  -0.625  -0.872  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.100  -1.662   0.262  1.00  0.00           C  
HETATM   23  O   UNL     1       0.285  -1.721   0.640  1.00  0.00           O  
HETATM   24  C   UNL     1      -1.562  -3.033  -0.235  1.00  0.00           C  
HETATM   25  O   UNL     1      -1.556  -3.961   0.852  1.00  0.00           O  
HETATM   26  C   UNL     1      -5.781   2.394   1.489  1.00  0.00           C  
HETATM   27  H   UNL     1      -5.423   1.521  -2.145  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.082   0.494  -1.016  1.00  0.00           H  
HETATM   29  H   UNL     1       4.110   3.609   0.593  1.00  0.00           H  
HETATM   30  H   UNL     1       7.655   0.819  -0.071  1.00  0.00           H  
HETATM   31  H   UNL     1       7.010  -0.725  -0.224  1.00  0.00           H  
HETATM   32  H   UNL     1       2.592  -2.681  -0.124  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.792   1.239  -0.029  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.907   2.429  -0.547  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.836   1.497   1.716  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.060  -0.171   0.878  1.00  0.00           H  
HETATM   37  H   UNL     1       0.606   0.304   1.072  1.00  0.00           H  
HETATM   38  H   UNL     1       0.729  -0.588  -1.864  1.00  0.00           H  
HETATM   39  H   UNL     1       1.087   1.733  -1.275  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.564  -1.101  -1.791  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.704  -1.352   1.114  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.572  -2.952  -0.638  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.887  -3.383  -1.015  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.839  -4.853   0.609  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.680   2.238   0.891  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.028   2.304   2.547  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.382   3.389   1.292  1.00  0.00           H  
CONECT    1    3    3   13   15                                       
CONECT    2   15   27   28                                            
CONECT    3    1    1                                                 
CONECT    4    5    5    9                                            
CONECT    5    4    4    6   29                                       
CONECT    6    5    7    7                                            
CONECT    7    6    6    8   14                                       
CONECT    8    7    9    9   11                                       
CONECT    9    4    8    8   10                                       
CONECT   10    9   30   31                                            
CONECT   11    8   12   12                                            
CONECT   12   11   11   14   32                                       
CONECT   13    1   21   33                                            
CONECT   14    7   12   18                                            
CONECT   15    1    2   16   34                                       
CONECT   16   15   17   26   35                                       
CONECT   17   16   36                                                 
CONECT   18   14   19   23   37                                       
CONECT   19   18   20   21   38                                       
CONECT   20   19   39                                                 
CONECT   21   13   19   22   40                                       
CONECT   22   21   23   24   41                                       
CONECT   23   18   22                                                 
CONECT   24   22   25   42   43                                       
CONECT   25   24   44                                                 
CONECT   26   16   45   46   47                                       
CONECT   27    2                                                      
CONECT   28    2                                                      
CONECT   29    5                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
