COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.746  -2.194  -1.094  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.022  -1.331  -0.636  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.627  -1.531  -0.201  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.139  -0.331   0.257  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.215   0.657   0.121  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.772   1.782  -0.815  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.904   2.801  -0.960  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.249   3.379   0.414  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.702   2.250   1.342  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.572   1.229   1.493  1.00  0.00           C  
HETATM   11  N   UNL     1      -3.366  -0.043  -0.452  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.843  -2.650  -0.199  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.405  -3.953  -0.708  1.00  0.00           C  
HETATM   14  C   UNL     1       0.474  -2.604   0.267  1.00  0.00           C  
HETATM   15  C   UNL     1       0.985  -1.411   0.732  1.00  0.00           C  
HETATM   16  C   UNL     1       0.122  -0.226   0.719  1.00  0.00           C  
HETATM   17  O   UNL     1       0.542   0.845   1.122  1.00  0.00           O  
HETATM   18  N   UNL     1       2.292  -1.332   1.203  1.00  0.00           N  
HETATM   19  C   UNL     1       3.197  -0.473   0.598  1.00  0.00           C  
HETATM   20  C   UNL     1       2.848   0.222  -0.557  1.00  0.00           C  
HETATM   21  C   UNL     1       3.791   1.072  -1.125  1.00  0.00           C  
HETATM   22  N   UNL     1       3.492   1.787  -2.274  1.00  0.00           N  
HETATM   23  N   UNL     1       4.986   1.190  -0.547  1.00  0.00           N  
HETATM   24  C   UNL     1       5.278   0.515   0.545  1.00  0.00           C  
HETATM   25  N   UNL     1       4.411  -0.296   1.116  1.00  0.00           N  
HETATM   26  H   UNL     1      -0.892   2.273  -0.402  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.531   1.366  -1.794  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.586   3.606  -1.623  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.783   2.311  -1.379  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.369   3.864   0.835  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.052   4.108   0.310  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.952   2.662   2.320  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.580   1.761   0.919  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.897   0.422   2.149  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.697   1.717   1.922  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.228   0.352  -0.660  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.213  -4.038  -1.778  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.930  -4.783  -0.186  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.480  -3.979  -0.529  1.00  0.00           H  
HETATM   40  H   UNL     1       1.085  -3.494   0.264  1.00  0.00           H  
HETATM   41  H   UNL     1       2.570  -1.879   1.954  1.00  0.00           H  
HETATM   42  H   UNL     1       1.870   0.104  -1.000  1.00  0.00           H  
HETATM   43  H   UNL     1       2.620   1.696  -2.689  1.00  0.00           H  
HETATM   44  H   UNL     1       4.155   2.378  -2.664  1.00  0.00           H  
HETATM   45  H   UNL     1       6.256   0.633   0.988  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2   11    3    1    1                                       
CONECT    3    4   12   12    2                                       
CONECT    4   16    5    3                                            
CONECT    5   10    6    4   11                                       
CONECT    6    7    5   26   27                                       
CONECT    7    8    6   28   29                                       
CONECT    8    9    7   30   31                                       
CONECT    9    8   10   32   33                                       
CONECT   10    9    5   34   35                                       
CONECT   11    5    2   36                                            
CONECT   12   14    3    3   13                                       
CONECT   13   12   37   38   39                                       
CONECT   14   15   15   12   40                                       
CONECT   15   18   16   14   14                                       
CONECT   16   17   17   15    4                                       
CONECT   17   16   16                                                 
CONECT   18   19   15   41                                            
CONECT   19   20   18   25   25                                       
CONECT   20   21   21   19   42                                       
CONECT   21   22   20   20   23                                       
CONECT   22   21   43   44                                            
CONECT   23   21   24   24                                            
CONECT   24   23   23   25   45                                       
CONECT   25   19   19   24                                            
CONECT   26    6                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   18                                                      
CONECT   42   20                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   24                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
