COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.945  -0.091  -1.974  1.00  0.00           N1+
HETATM    2  C   UNL     1      -4.593  -0.242   0.062  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.619   0.587  -0.713  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.889   0.741   0.127  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.866   1.673  -0.593  1.00  0.00           C  
HETATM    6  C   UNL     1      -9.117   1.824   0.234  1.00  0.00           C  
HETATM    7  O   UNL     1      -9.217   1.241   1.300  1.00  0.00           O  
HETATM    8  O   UNL     1     -10.028   2.531  -0.163  1.00  0.00           O1-
HETATM    9  P   UNL     1      -2.339  -1.172   0.198  1.00  0.00           P  
HETATM   10  O   UNL     1      -2.225  -0.581   1.620  1.00  0.00           O  
HETATM   11  O   UNL     1      -2.855  -2.626   0.284  1.00  0.00           O1-
HETATM   12  O   UNL     1      -3.367  -0.289  -0.671  1.00  0.00           O  
HETATM   13  O   UNL     1      -0.891  -1.158  -0.506  1.00  0.00           O  
HETATM   14  C   UNL     1       0.000  -1.856   0.366  1.00  0.00           C  
HETATM   15  C   UNL     1       1.401  -1.879  -0.247  1.00  0.00           C  
HETATM   16  O   UNL     1       1.949  -0.543  -0.300  1.00  0.00           O  
HETATM   17  C   UNL     1       3.378  -0.722  -0.409  1.00  0.00           C  
HETATM   18  N   UNL     1       4.078   0.493   0.013  1.00  0.00           N  
HETATM   19  C   UNL     1       5.354   0.858  -0.335  1.00  0.00           C  
HETATM   20  N   UNL     1       6.311   0.322  -1.085  1.00  0.00           N  
HETATM   21  C   UNL     1       7.468   0.932  -1.233  1.00  0.00           C  
HETATM   22  N   UNL     1       7.739   2.088  -0.655  1.00  0.00           N  
HETATM   23  C   UNL     1       6.843   2.700   0.114  1.00  0.00           C  
HETATM   24  N   UNL     1       7.136   3.911   0.715  1.00  0.00           N  
HETATM   25  C   UNL     1       5.595   2.085   0.307  1.00  0.00           C  
HETATM   26  N   UNL     1       4.471   2.404   0.993  1.00  0.00           N  
HETATM   27  C   UNL     1       3.581   1.469   0.825  1.00  0.00           C  
HETATM   28  C   UNL     1       3.706  -1.892   0.546  1.00  0.00           C  
HETATM   29  O   UNL     1       4.728  -2.725  -0.006  1.00  0.00           O  
HETATM   30  C   UNL     1       2.373  -2.669   0.656  1.00  0.00           C  
HETATM   31  O   UNL     1       2.531  -4.005   0.174  1.00  0.00           O  
HETATM   32  H   UNL     1      -5.108  -0.192  -2.528  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.330  -1.002  -1.776  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.622   0.456  -2.485  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.973  -1.255   0.198  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.417   0.214   1.036  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.203   1.572  -0.926  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.353  -0.235   0.266  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.633   1.163   1.099  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.402   2.649  -0.732  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.122   1.251  -1.565  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.353  -2.878   0.505  1.00  0.00           H  
HETATM   43  H   UNL     1       0.034  -1.349   1.331  1.00  0.00           H  
HETATM   44  H   UNL     1       1.370  -2.316  -1.245  1.00  0.00           H  
HETATM   45  H   UNL     1       3.651  -0.980  -1.433  1.00  0.00           H  
HETATM   46  H   UNL     1       8.225   0.470  -1.850  1.00  0.00           H  
HETATM   47  H   UNL     1       8.003   4.324   0.578  1.00  0.00           H  
HETATM   48  H   UNL     1       6.473   4.350   1.271  1.00  0.00           H  
HETATM   49  H   UNL     1       2.594   1.468   1.263  1.00  0.00           H  
HETATM   50  H   UNL     1       4.009  -1.512   1.522  1.00  0.00           H  
HETATM   51  H   UNL     1       4.843  -3.466   0.605  1.00  0.00           H  
HETATM   52  H   UNL     1       2.018  -2.675   1.687  1.00  0.00           H  
HETATM   53  H   UNL     1       3.145  -4.448   0.775  1.00  0.00           H  
CONECT    1    3   32   33   34                                       
CONECT    2    3   12   35   36                                       
CONECT    3    1    2    4   37                                       
CONECT    4    3    5   38   39                                       
CONECT    5    4    6   40   41                                       
CONECT    6    5    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6                                                      
CONECT    9   10   10   11   12                                       
CONECT    9   13                                                      
CONECT   10    9    9                                                 
CONECT   11    9                                                      
CONECT   12    2    9                                                 
CONECT   13    9   14                                                 
CONECT   14   13   15   42   43                                       
CONECT   15   14   16   30   44                                       
CONECT   16   15   17                                                 
CONECT   17   16   18   28   45                                       
CONECT   18   17   19   27                                            
CONECT   19   18   20   20   25                                       
CONECT   20   19   19   21                                            
CONECT   21   20   22   22   46                                       
CONECT   22   21   21   23                                            
CONECT   23   22   24   25   25                                       
CONECT   24   23   47   48                                            
CONECT   25   19   23   23   26                                       
CONECT   26   25   27   27                                            
CONECT   27   18   26   26   49                                       
CONECT   28   17   29   30   50                                       
CONECT   29   28   51                                                 
CONECT   30   15   28   31   52                                       
CONECT   31   30   53                                                 
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   17                                                      
CONECT   46   21                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53   31                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
