COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -2.188   3.366  -0.382  1.00  0.00           F  
HETATM    2  C   UNL     1      -1.232   2.435  -0.170  1.00  0.00           C  
HETATM    3  C   UNL     1       0.108   2.780  -0.187  1.00  0.00           C  
HETATM    4  N   UNL     1       1.020   1.842   0.025  1.00  0.00           N  
HETATM    5  C   UNL     1      -1.574   1.101   0.078  1.00  0.00           C  
HETATM    6  N   UNL     1      -0.603   0.214   0.283  1.00  0.00           N  
HETATM    7  C   UNL     1       0.667   0.586   0.252  1.00  0.00           C  
HETATM    8  N   UNL     1       1.653  -0.363   0.469  1.00  0.00           N  
HETATM    9  C   UNL     1       3.065   0.029   0.445  1.00  0.00           C  
HETATM   10  C   UNL     1       3.882  -0.956   1.283  1.00  0.00           C  
HETATM   11  C   UNL     1       5.356  -0.547   1.259  1.00  0.00           C  
HETATM   12  C   UNL     1       3.574   0.015  -0.998  1.00  0.00           C  
HETATM   13  C   UNL     1       5.048   0.424  -1.023  1.00  0.00           C  
HETATM   14  C   UNL     1       5.865  -0.561  -0.184  1.00  0.00           C  
HETATM   15  N   UNL     1       7.280  -0.168  -0.208  1.00  0.00           N1+
HETATM   16  C   UNL     1      -2.996   0.682   0.113  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.115   1.515  -0.086  1.00  0.00           C  
HETATM   18  N   UNL     1      -5.190   0.781   0.022  1.00  0.00           N  
HETATM   19  N   UNL     1      -4.805  -0.538   0.291  1.00  0.00           N  
HETATM   20  C   UNL     1      -5.709  -1.674   0.481  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.460  -0.583   0.338  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.619  -1.806   0.596  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.290  -2.489  -0.733  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.819  -2.556  -1.148  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.539  -3.821  -0.677  1.00  0.00           C  
HETATM   26  H   UNL     1       0.407   3.801  -0.371  1.00  0.00           H  
HETATM   27  H   UNL     1       1.409  -1.286   0.636  1.00  0.00           H  
HETATM   28  H   UNL     1       3.170   1.032   0.858  1.00  0.00           H  
HETATM   29  H   UNL     1       3.519  -0.946   2.311  1.00  0.00           H  
HETATM   30  H   UNL     1       3.776  -1.959   0.871  1.00  0.00           H  
HETATM   31  H   UNL     1       5.461   0.456   1.672  1.00  0.00           H  
HETATM   32  H   UNL     1       5.938  -1.249   1.856  1.00  0.00           H  
HETATM   33  H   UNL     1       3.468  -0.988  -1.411  1.00  0.00           H  
HETATM   34  H   UNL     1       2.992   0.717  -1.595  1.00  0.00           H  
HETATM   35  H   UNL     1       5.410   0.415  -2.050  1.00  0.00           H  
HETATM   36  H   UNL     1       5.153   1.428  -0.610  1.00  0.00           H  
HETATM   37  H   UNL     1       5.759  -1.564  -0.597  1.00  0.00           H  
HETATM   38  H   UNL     1       7.819  -0.817   0.345  1.00  0.00           H  
HETATM   39  H   UNL     1       7.616  -0.177  -1.160  1.00  0.00           H  
HETATM   40  H   UNL     1       7.378   0.761   0.174  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.089   2.575  -0.290  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.899  -2.152  -0.480  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.250  -2.394   1.160  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.649  -1.323   0.906  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.694  -1.514   1.093  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.170  -2.498   1.233  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.031  -2.362  -1.523  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.592  -2.472  -2.211  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.085  -2.113  -0.474  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.279  -4.211   0.307  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.785  -4.570  -1.430  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    3    3    5    1                                       
CONECT    3    4    2    2   26                                       
CONECT    4    7    7    3                                            
CONECT    5    6    6    2   16                                       
CONECT    6    7    5    5                                            
CONECT    7    8    4    4    6                                       
CONECT    8    9    7   27                                            
CONECT    9   10   12    8   28                                       
CONECT   10   11    9   29   30                                       
CONECT   11   14   10   31   32                                       
CONECT   12   13    9   33   34                                       
CONECT   13   14   12   35   36                                       
CONECT   14   15   11   13   37                                       
CONECT   15   14   38   39   40                                       
CONECT   16    5   21   21   17                                       
CONECT   17   16   18   18   41                                       
CONECT   18   19   17   17                                            
CONECT   19   21   20   18                                            
CONECT   20   19   42   43   44                                       
CONECT   21   22   16   16   19                                       
CONECT   22   23   21   45   46                                       
CONECT   23   22   24   25   47                                       
CONECT   24   23   25   48   49                                       
CONECT   25   24   23   50   51                                       
CONECT   26    3                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
