COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.936   0.418   0.465  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.044   0.806  -0.819  1.00  0.00           C  
HETATM    3  O   UNL     1      -2.361   0.261  -1.670  1.00  0.00           O  
HETATM    4  N   UNL     1      -3.884   1.776  -1.176  1.00  0.00           N  
HETATM    5  C   UNL     1      -4.638   2.386  -0.271  1.00  0.00           C  
HETATM    6  N   UNL     1      -5.503   3.386  -0.652  1.00  0.00           N  
HETATM    7  C   UNL     1      -4.549   2.003   1.083  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.695   1.011   1.429  1.00  0.00           C  
HETATM    9  C   UNL     1       3.391  -0.474  -0.739  1.00  0.00           C  
HETATM   10  C   UNL     1       4.244   1.014   1.088  1.00  0.00           C  
HETATM   11  C   UNL     1       5.245   1.817   1.599  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.004  -0.652   0.827  1.00  0.00           C  
HETATM   13  N   UNL     1       6.366   2.007   0.933  1.00  0.00           N  
HETATM   14  C   UNL     1       6.587   1.448  -0.240  1.00  0.00           C  
HETATM   15  C   UNL     1       5.639   0.631  -0.825  1.00  0.00           C  
HETATM   16  C   UNL     1       4.437   0.396  -0.152  1.00  0.00           C  
HETATM   17  O   UNL     1       3.573  -0.995  -1.822  1.00  0.00           O  
HETATM   18  C   UNL     1      -2.395  -1.969   0.121  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.138  -2.811   1.005  1.00  0.00           O  
HETATM   20  C   UNL     1      -1.041  -2.621  -0.237  1.00  0.00           C  
HETATM   21  O   UNL     1      -0.905  -3.884   0.416  1.00  0.00           O  
HETATM   22  C   UNL     1       0.009  -1.621   0.296  1.00  0.00           C  
HETATM   23  O   UNL     1      -0.678  -0.351   0.338  1.00  0.00           O  
HETATM   24  C   UNL     1       1.206  -1.547  -0.655  1.00  0.00           C  
HETATM   25  N   UNL     1       2.239  -0.687  -0.073  1.00  0.00           N  
HETATM   26  H   UNL     1      -5.562   3.647  -1.584  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.053   3.830   0.012  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.156   2.490   1.832  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.609   0.699   2.460  1.00  0.00           H  
HETATM   30  H   UNL     1       3.328   0.862   1.639  1.00  0.00           H  
HETATM   31  H   UNL     1       5.107   2.295   2.557  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.987  -0.790   1.908  1.00  0.00           H  
HETATM   33  H   UNL     1       7.520   1.632  -0.751  1.00  0.00           H  
HETATM   34  H   UNL     1       5.826   0.176  -1.787  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.971  -1.762  -0.781  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.409  -3.651   0.613  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.945  -2.736  -1.316  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.577  -4.532   0.163  1.00  0.00           H  
HETATM   39  H   UNL     1       0.335  -1.909   1.296  1.00  0.00           H  
HETATM   40  H   UNL     1       1.610  -2.547  -0.808  1.00  0.00           H  
HETATM   41  H   UNL     1       0.885  -1.134  -1.611  1.00  0.00           H  
HETATM   42  H   UNL     1       2.094  -0.270   0.790  1.00  0.00           H  
CONECT    1    8   12    2                                            
CONECT    2    1    4    3    3                                       
CONECT    3    2    2                                                 
CONECT    4    2    5    5                                            
CONECT    5    4    4    7    6                                       
CONECT    6    5   26   27                                            
CONECT    7    5    8    8   28                                       
CONECT    8    1    7    7   29                                       
CONECT    9   17   17   16   25                                       
CONECT   10   11   11   16   30                                       
CONECT   11   10   10   13   31                                       
CONECT   12    1   18   23   32                                       
CONECT   13   11   14   14                                            
CONECT   14   13   13   15   33                                       
CONECT   15   14   16   16   34                                       
CONECT   16    9   10   15   15                                       
CONECT   17    9    9                                                 
CONECT   18   12   20   19   35                                       
CONECT   19   18   36                                                 
CONECT   20   18   21   22   37                                       
CONECT   21   20   38                                                 
CONECT   22   20   24   23   39                                       
CONECT   23   12   22                                                 
CONECT   24   22   25   40   41                                       
CONECT   25    9   24   42                                            
CONECT   26    6                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   24                                                      
CONECT   41   24                                                      
CONECT   42   25                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
