COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.675  -2.149  -0.538  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.498   0.908  -0.396  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.822   2.403  -0.419  1.00  0.00           C  
HETATM    4  O   UNL     1      -5.643  -1.373   1.945  1.00  0.00           O  
HETATM    5  C   UNL     1      -1.353  -0.611  -0.025  1.00  0.00           C  
HETATM    6  N   UNL     1       7.692  -0.988  -0.201  1.00  0.00           N1+
HETATM    7  C   UNL     1      -1.009   0.226   1.026  1.00  0.00           C  
HETATM    8  C   UNL     1       0.258   0.772   1.088  1.00  0.00           C  
HETATM    9  C   UNL     1       1.188   0.482   0.099  1.00  0.00           C  
HETATM   10  O   UNL     1      -2.603  -1.143  -0.089  1.00  0.00           O  
HETATM   11  C   UNL     1       0.843  -0.357  -0.953  1.00  0.00           C  
HETATM   12  O   UNL     1       7.931  -2.168  -0.381  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.425  -0.901  -1.014  1.00  0.00           C  
HETATM   14  C   UNL     1       2.752   2.363   0.356  1.00  0.00           C  
HETATM   15  C   UNL     1       4.080   2.556   0.369  1.00  0.00           C  
HETATM   16  O   UNL     1       8.607  -0.191  -0.091  1.00  0.00           O1-
HETATM   17  C   UNL     1       4.706   1.247   0.167  1.00  0.00           C  
HETATM   18  C   UNL     1       3.650   0.325   0.042  1.00  0.00           C  
HETATM   19  C   UNL     1       6.290  -0.521  -0.114  1.00  0.00           C  
HETATM   20  C   UNL     1       6.028   0.805   0.086  1.00  0.00           C  
HETATM   21  C   UNL     1       5.252  -1.433  -0.240  1.00  0.00           C  
HETATM   22  C   UNL     1       3.939  -1.020  -0.163  1.00  0.00           C  
HETATM   23  N   UNL     1       2.475   1.036   0.161  1.00  0.00           N  
HETATM   24  C   UNL     1      -3.508  -0.802   0.963  1.00  0.00           C  
HETATM   25  O   UNL     1      -3.877   0.573   0.847  1.00  0.00           O  
HETATM   26  O   UNL     1      -3.607   3.154  -0.391  1.00  0.00           O  
HETATM   27  C   UNL     1      -5.791   0.102  -0.552  1.00  0.00           C  
HETATM   28  O   UNL     1      -6.384   0.392  -1.819  1.00  0.00           O  
HETATM   29  C   UNL     1      -5.466  -1.392  -0.468  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.760  -1.676   0.862  1.00  0.00           C  
HETATM   31  H   UNL     1      -6.544  -3.106  -0.491  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.821   0.670  -1.217  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.376   2.641  -1.327  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.427   2.657   0.452  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.259  -1.525   2.819  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.732   0.452   1.796  1.00  0.00           H  
HETATM   37  H   UNL     1       0.526   1.424   1.906  1.00  0.00           H  
HETATM   38  H   UNL     1       1.566  -0.583  -1.723  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.694  -1.550  -1.834  1.00  0.00           H  
HETATM   40  H   UNL     1       2.011   3.139   0.484  1.00  0.00           H  
HETATM   41  H   UNL     1       4.591   3.498   0.503  1.00  0.00           H  
HETATM   42  H   UNL     1       6.841   1.510   0.181  1.00  0.00           H  
HETATM   43  H   UNL     1       5.474  -2.478  -0.400  1.00  0.00           H  
HETATM   44  H   UNL     1       3.138  -1.737  -0.260  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.025  -0.969   1.926  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.737   4.112  -0.403  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.485   0.370   0.245  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.209  -0.085  -1.986  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.813  -1.670  -1.295  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.476  -2.727   0.908  1.00  0.00           H  
CONECT    1   29   31                                                 
CONECT    2   25   27    3   32                                       
CONECT    3    2   26   33   34                                       
CONECT    4   30   35                                                 
CONECT    5    7    7   13   10                                       
CONECT    6   16   19   12   12                                       
CONECT    7    8    5    5   36                                       
CONECT    8    9    9    7   37                                       
CONECT    9   23    8    8   11                                       
CONECT   10    5   24                                                 
CONECT   11    9   13   13   38                                       
CONECT   12    6    6                                                 
CONECT   13   11   11    5   39                                       
CONECT   14   15   15   23   40                                       
CONECT   15   14   14   17   41                                       
CONECT   16    6                                                      
CONECT   17   15   20   20   18                                       
CONECT   18   17   23   22   22                                       
CONECT   19   20    6   21   21                                       
CONECT   20   17   17   19   42                                       
CONECT   21   19   19   22   43                                       
CONECT   22   18   18   21   44                                       
CONECT   23   14    9   18                                            
CONECT   24   10   30   25   45                                       
CONECT   25   24    2                                                 
CONECT   26    3   46                                                 
CONECT   27   29    2   28   47                                       
CONECT   28   27   48                                                 
CONECT   29   30    1   27   49                                       
CONECT   30   24    4   29   50                                       
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   24                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   29                                                      
CONECT   50   30                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
