COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.573  -2.996   0.030  1.00  0.00           N  
HETATM    2  C   UNL     1       4.676  -2.073   0.239  1.00  0.00           C  
HETATM    3  N   UNL     1       5.235  -0.860  -0.018  1.00  0.00           N  
HETATM    4  C   UNL     1       6.533  -1.089  -0.399  1.00  0.00           C  
HETATM    5  C   UNL     1       6.721  -2.421  -0.362  1.00  0.00           C  
HETATM    6  C   UNL     1       7.553  -0.049  -0.786  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.575  -0.754  -0.297  1.00  0.00           C  
HETATM    8  N   UNL     1       5.292   1.476  -0.203  1.00  0.00           N  
HETATM    9  C   UNL     1       4.607   0.381   0.085  1.00  0.00           C  
HETATM   10  N   UNL     1       3.342   0.435   0.468  1.00  0.00           N  
HETATM   11  C   UNL     1       2.716   1.595   0.576  1.00  0.00           C  
HETATM   12  C   UNL     1       3.403   2.763   0.282  1.00  0.00           C  
HETATM   13  C   UNL     1       4.727   2.670  -0.116  1.00  0.00           C  
HETATM   14  C   UNL     1       1.275   1.648   1.012  1.00  0.00           C  
HETATM   15  C   UNL     1       0.432   0.760   0.095  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.973   0.810   0.520  1.00  0.00           N  
HETATM   17  C   UNL     1      -6.418   0.212  -0.813  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.814  -0.032  -0.340  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.267   0.046   0.133  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.144  -0.832  -0.763  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.733   0.282  -0.384  1.00  0.00           C  
HETATM   22  C   UNL     1      -8.201  -0.615   0.560  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.356  -1.581   1.074  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.042  -1.647   0.650  1.00  0.00           C  
HETATM   25  F   UNL     1      -8.557   1.227  -0.887  1.00  0.00           F  
HETATM   26  H   UNL     1       3.659  -2.243   0.562  1.00  0.00           H  
HETATM   27  H   UNL     1       7.637  -2.939  -0.605  1.00  0.00           H  
HETATM   28  H   UNL     1       8.099   0.272   0.101  1.00  0.00           H  
HETATM   29  H   UNL     1       8.250  -0.475  -1.507  1.00  0.00           H  
HETATM   30  H   UNL     1       7.047   0.808  -1.231  1.00  0.00           H  
HETATM   31  H   UNL     1       5.292   3.560  -0.352  1.00  0.00           H  
HETATM   32  H   UNL     1       2.917   3.725   0.361  1.00  0.00           H  
HETATM   33  H   UNL     1       1.193   1.291   2.039  1.00  0.00           H  
HETATM   34  H   UNL     1       0.915   2.675   0.955  1.00  0.00           H  
HETATM   35  H   UNL     1       0.514   1.117  -0.932  1.00  0.00           H  
HETATM   36  H   UNL     1       0.792  -0.268   0.152  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.068   0.545   1.489  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.748   0.319  -1.370  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.470  -1.065  -0.286  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.334  -0.305   1.163  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.612   1.079   0.079  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.799  -1.865  -0.709  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.077  -0.480  -1.793  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.383  -2.402   1.052  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.721  -2.281   1.811  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.226  -0.561   0.895  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.051   0.911  -1.549  1.00  0.00           H  
CONECT    1    2    2    5                                            
CONECT    2    1    1    3   26                                       
CONECT    3    2    4    9                                            
CONECT    4    3    5    5    6                                       
CONECT    5    1    4    4   27                                       
CONECT    6    4   28   29   30                                       
CONECT    7   17   17   20   24                                       
CONECT    8    9    9   13                                            
CONECT    9    3    8    8   10                                       
CONECT   10    9   11   11                                            
CONECT   11   10   10   12   14                                       
CONECT   12   11   13   13   32                                       
CONECT   13    8   12   12   31                                       
CONECT   14   11   15   33   34                                       
CONECT   15   14   16   35   36                                       
CONECT   16   15   18   37                                            
CONECT   17    7    7   21   47                                       
CONECT   18   16   19   38   39                                       
CONECT   19   18   20   40   41                                       
CONECT   20    7   19   42   43                                       
CONECT   21   17   22   22   25                                       
CONECT   22   21   21   23   46                                       
CONECT   23   22   24   24   45                                       
CONECT   24    7   23   23   44                                       
CONECT   25   21                                                      
CONECT   26    2                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31   13                                                      
CONECT   32   12                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   24                                                      
CONECT   45   23                                                      
CONECT   46   22                                                      
CONECT   47   17                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
