COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -6.268  -1.674  -0.683  1.00  0.00           N1+
HETATM    2  N   UNL     1      -3.692  -0.065  -0.127  1.00  0.00           N  
HETATM    3  N   UNL     1      -0.751  -0.212  -0.124  1.00  0.00           N  
HETATM    4  N   UNL     1       5.625   0.407  -0.185  1.00  0.00           N  
HETATM    5  N   UNL     1       7.018   0.303  -0.082  1.00  0.00           N  
HETATM    6  N   UNL     1       9.189   1.212  -0.457  1.00  0.00           N  
HETATM    7  N   UNL     1       7.285   2.371  -1.103  1.00  0.00           N  
HETATM    8  C   UNL     1      -7.390   0.430  -0.016  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.360   1.751   0.413  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.171   2.383   0.634  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.968   1.695   0.427  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.996   0.356  -0.008  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.222  -0.267  -0.226  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.605   2.059   0.557  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.855   0.976   0.222  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.385   0.923   0.230  1.00  0.00           C  
HETATM   17  C   UNL     1       0.640  -0.295  -0.024  1.00  0.00           C  
HETATM   18  C   UNL     1       1.238  -1.497   0.335  1.00  0.00           C  
HETATM   19  C   UNL     1       2.613  -1.589   0.435  1.00  0.00           C  
HETATM   20  C   UNL     1       3.395  -0.464   0.169  1.00  0.00           C  
HETATM   21  C   UNL     1       2.793   0.744  -0.190  1.00  0.00           C  
HETATM   22  C   UNL     1       1.421   0.825  -0.291  1.00  0.00           C  
HETATM   23  C   UNL     1       3.230  -2.902   0.832  1.00  0.00           C  
HETATM   24  C   UNL     1       4.681  -2.994   0.370  1.00  0.00           C  
HETATM   25  C   UNL     1       5.462  -1.785   0.902  1.00  0.00           C  
HETATM   26  C   UNL     1       4.868  -0.547   0.263  1.00  0.00           C  
HETATM   27  C   UNL     1       7.821   1.315  -0.558  1.00  0.00           C  
HETATM   28  O   UNL     1      -7.342  -2.217  -0.873  1.00  0.00           O  
HETATM   29  O   UNL     1      -5.233  -2.288  -0.873  1.00  0.00           O1-
HETATM   30  O   UNL     1      -0.743   1.903   0.556  1.00  0.00           O  
HETATM   31  H   UNL     1      -3.408  -0.950  -0.406  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.260  -0.972  -0.447  1.00  0.00           H  
HETATM   33  H   UNL     1       9.588   0.427  -0.051  1.00  0.00           H  
HETATM   34  H   UNL     1       9.755   1.926  -0.792  1.00  0.00           H  
HETATM   35  H   UNL     1       7.850   3.084  -1.438  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.340  -0.055  -0.187  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.286   2.283   0.572  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.157   3.410   0.967  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.230   3.022   0.868  1.00  0.00           H  
HETATM   40  H   UNL     1       0.625  -2.362   0.538  1.00  0.00           H  
HETATM   41  H   UNL     1       3.401   1.613  -0.392  1.00  0.00           H  
HETATM   42  H   UNL     1       0.952   1.756  -0.572  1.00  0.00           H  
HETATM   43  H   UNL     1       3.193  -3.000   1.917  1.00  0.00           H  
HETATM   44  H   UNL     1       2.660  -3.715   0.382  1.00  0.00           H  
HETATM   45  H   UNL     1       5.127  -3.912   0.753  1.00  0.00           H  
HETATM   46  H   UNL     1       4.717  -3.000  -0.719  1.00  0.00           H  
HETATM   47  H   UNL     1       5.363  -1.727   1.986  1.00  0.00           H  
HETATM   48  H   UNL     1       6.514  -1.875   0.630  1.00  0.00           H  
HETATM   49  H   UNL     1       7.417  -0.482   0.323  1.00  0.00           H  
CONECT    1   29   28   28   13                                       
CONECT    2   12   15   31                                            
CONECT    3   16   17   32                                            
CONECT    4   26   26    5                                            
CONECT    5    4   27   49                                            
CONECT    6   27   33   34                                            
CONECT    7   27   27   35                                            
CONECT    8   13   13    9   36                                       
CONECT    9    8   10   10   37                                       
CONECT   10    9    9   11   38                                       
CONECT   11   12   12   10   14                                       
CONECT   12   13    2   11   11                                       
CONECT   13    1    8    8   12                                       
CONECT   14   11   15   15   39                                       
CONECT   15    2   14   14   16                                       
CONECT   16   15   30   30    3                                       
CONECT   17    3   18   22   22                                       
CONECT   18   17   19   19   40                                       
CONECT   19   18   18   23   20                                       
CONECT   20   19   21   21   26                                       
CONECT   21   22   20   20   41                                       
CONECT   22   17   17   21   42                                       
CONECT   23   19   24   43   44                                       
CONECT   24   23   25   45   46                                       
CONECT   25   24   26   47   48                                       
CONECT   26   20   25    4    4                                       
CONECT   27    5    7    7    6                                       
CONECT   28    1    1                                                 
CONECT   29    1                                                      
CONECT   30   16   16                                                 
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   14                                                      
CONECT   40   18                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49    5                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
