COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.186   1.795   1.364  1.00  0.00           C  
HETATM    2  N   UNL     1      -5.627   4.545  -0.977  1.00  0.00           N  
HETATM    3  C   UNL     1      -5.588   2.990   0.870  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.127   1.322  -0.679  1.00  0.00           C  
HETATM    5  O   UNL     1       6.680   1.431  -0.197  1.00  0.00           O  
HETATM    6  P   UNL     1       5.497   1.888   0.565  1.00  0.00           P  
HETATM    7  O   UNL     1       5.953   2.353   2.037  1.00  0.00           O  
HETATM    8  O   UNL     1       4.811   3.127  -0.201  1.00  0.00           O  
HETATM    9  O   UNL     1       4.438   0.681   0.687  1.00  0.00           O  
HETATM   10  P   UNL     1       3.926  -0.464  -0.323  1.00  0.00           P  
HETATM   11  O   UNL     1       5.004  -1.658  -0.371  1.00  0.00           O  
HETATM   12  O   UNL     1       3.765   0.110  -1.678  1.00  0.00           O  
HETATM   13  O   UNL     1       2.512  -1.038   0.189  1.00  0.00           O  
HETATM   14  P   UNL     1       1.356  -1.932  -0.488  1.00  0.00           P  
HETATM   15  O   UNL     1       1.789  -3.482  -0.455  1.00  0.00           O  
HETATM   16  O   UNL     1       1.160  -1.504  -1.891  1.00  0.00           O  
HETATM   17  O   UNL     1      -0.018  -1.740   0.329  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.256  -2.321  -0.085  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.355  -1.943   0.911  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.670  -2.651   0.534  1.00  0.00           C  
HETATM   21  O   UNL     1      -4.106  -3.498   1.599  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.675  -1.494   0.316  1.00  0.00           C  
HETATM   23  O   UNL     1      -4.790  -1.173  -1.072  1.00  0.00           O  
HETATM   24  O   UNL     1      -2.600  -0.528   0.854  1.00  0.00           O  
HETATM   25  C   UNL     1      -4.010  -0.334   1.099  1.00  0.00           C  
HETATM   26  N   UNL     1      -4.451   0.961   0.576  1.00  0.00           N  
HETATM   27  C   UNL     1      -5.232   3.338  -0.450  1.00  0.00           C  
HETATM   28  N   UNL     1      -4.515   2.493  -1.180  1.00  0.00           N  
HETATM   29  O   UNL     1      -3.468   0.563  -1.370  1.00  0.00           O  
HETATM   30  H   UNL     1      -5.442   1.508   2.373  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.152   5.160  -0.441  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.381   4.781  -1.885  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.172   3.666   1.476  1.00  0.00           H  
HETATM   34  H   UNL     1       6.591   3.078   2.040  1.00  0.00           H  
HETATM   35  H   UNL     1       4.028   3.479   0.243  1.00  0.00           H  
HETATM   36  H   UNL     1       5.161  -2.082   0.484  1.00  0.00           H  
HETATM   37  H   UNL     1       1.935  -3.831   0.435  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.520  -1.948  -1.075  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.155  -3.406  -0.120  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.054  -2.227   1.919  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.544  -3.228  -0.383  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.959  -3.924   1.439  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.649  -1.740   0.739  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.118  -1.900  -1.618  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.229  -0.414   2.164  1.00  0.00           H  
CONECT    1   26    3    3   30                                       
CONECT    2   27   31   32                                            
CONECT    3    1    1   27   33                                       
CONECT    4   26   29   29   28                                       
CONECT    5    6    6                                                 
CONECT    6    5    5    8    7                                       
CONECT    6    9                                                      
CONECT    7    6   34                                                 
CONECT    8    6   35                                                 
CONECT    9    6   10                                                 
CONECT   10   12   12    9   13                                       
CONECT   10   11                                                      
CONECT   11   10   36                                                 
CONECT   12   10   10                                                 
CONECT   13   10   14                                                 
CONECT   14   13   17   16   16                                       
CONECT   14   15                                                      
CONECT   15   14   37                                                 
CONECT   16   14   14                                                 
CONECT   17   18   14                                                 
CONECT   18   19   17   38   39                                       
CONECT   19   20   18   24   40                                       
CONECT   20   21   22   19   41                                       
CONECT   21   20   42                                                 
CONECT   22   23   20   25   43                                       
CONECT   23   22   44                                                 
CONECT   24   19   25                                                 
CONECT   25   22   24   26   45                                       
CONECT   26   25    1    4                                            
CONECT   27    3   28   28    2                                       
CONECT   28    4   27   27                                            
CONECT   29    4    4                                                 
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   11                                                      
CONECT   37   15                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   25                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
