COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.281   0.295  -1.010  1.00  0.00           N  
HETATM    2  C   UNL     1      -6.448   0.918  -0.971  1.00  0.00           C  
HETATM    3  N   UNL     1      -7.464   0.535  -1.840  1.00  0.00           N  
HETATM    4  C   UNL     1      -6.668   1.954  -0.068  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.649   2.324   0.790  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.440   1.645   0.717  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.291   0.627  -0.203  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.846   3.441   1.783  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.982  -0.113  -0.288  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.825  -1.499  -0.500  1.00  0.00           O  
HETATM   11  N   UNL     1      -3.101  -3.218   1.651  1.00  0.00           N  
HETATM   12  C   UNL     1       0.235  -2.061  -1.276  1.00  0.00           C  
HETATM   13  C   UNL     1       1.337  -1.017  -1.468  1.00  0.00           C  
HETATM   14  N   UNL     1       1.937  -0.695  -0.166  1.00  0.00           N  
HETATM   15  C   UNL     1       3.002   0.307  -0.312  1.00  0.00           C  
HETATM   16  C   UNL     1       4.093   0.338   0.760  1.00  0.00           C  
HETATM   17  C   UNL     1       3.041   1.449   0.706  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.737  -1.922   1.300  1.00  0.00           C  
HETATM   19  C   UNL     1       5.492   0.684   0.318  1.00  0.00           C  
HETATM   20  C   UNL     1       6.520  -0.220   0.511  1.00  0.00           C  
HETATM   21  C   UNL     1       7.805   0.098   0.105  1.00  0.00           C  
HETATM   22  F   UNL     1       8.811  -0.785   0.292  1.00  0.00           F  
HETATM   23  C   UNL     1       8.059   1.320  -0.494  1.00  0.00           C  
HETATM   24  C   UNL     1       7.030   2.222  -0.685  1.00  0.00           C  
HETATM   25  C   UNL     1       5.746   1.902  -0.285  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.233  -1.614  -0.126  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.911  -2.397  -0.261  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.727  -3.112   1.094  1.00  0.00           C  
HETATM   29  H   UNL     1      -7.315  -0.187  -2.471  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.320   0.988  -1.815  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.621   2.461  -0.038  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.625   1.910   1.374  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.233   3.033   2.717  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.892   3.934   1.969  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.557   4.163   1.381  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.519   0.075  -1.257  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.318   0.231   0.505  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.600  -3.990   1.235  1.00  0.00           H  
HETATM   39  H   UNL     1       0.643  -2.930  -0.758  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.150  -2.366  -2.249  1.00  0.00           H  
HETATM   41  H   UNL     1       3.295   0.536  -1.336  1.00  0.00           H  
HETATM   42  H   UNL     1       4.022  -0.384   1.573  1.00  0.00           H  
HETATM   43  H   UNL     1       3.361   2.429   0.352  1.00  0.00           H  
HETATM   44  H   UNL     1       2.277   1.457   1.484  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.823  -2.018   1.307  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.419  -1.143   1.993  1.00  0.00           H  
HETATM   47  H   UNL     1       6.321  -1.173   0.978  1.00  0.00           H  
HETATM   48  H   UNL     1       9.061   1.569  -0.810  1.00  0.00           H  
HETATM   49  H   UNL     1       7.227   3.176  -1.152  1.00  0.00           H  
HETATM   50  H   UNL     1       4.941   2.605  -0.438  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.956  -1.958  -0.866  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.983  -3.125  -1.069  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.094  -2.519   1.755  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.299  -4.103   0.946  1.00  0.00           H  
HETATM   55  H   UNL     1       1.235  -0.384   0.489  1.00  0.00           H  
HETATM   56  H   UNL     1       2.103  -1.416  -2.133  1.00  0.00           H  
HETATM   57  H   UNL     1       0.910  -0.115  -1.905  1.00  0.00           H  
CONECT    1    2    2    7                                            
CONECT    2    1    1    3    4                                       
CONECT    3    2   29   30                                            
CONECT    4    2   31    5    5                                       
CONECT    5    4    4    6    8                                       
CONECT    6    5    7    7   32                                       
CONECT    7    6    6    1    9                                       
CONECT    8    5   33   34   35                                       
CONECT    9    7   36   37   26                                       
CONECT   10   12   27                                                 
CONECT   11   28   18   38                                            
CONECT   12   10   13   39   40                                       
CONECT   13   12   14   56   57                                       
CONECT   14   13   15   55                                            
CONECT   15   14   41   16   17                                       
CONECT   16   15   17   19   42                                       
CONECT   17   16   15   43   44                                       
CONECT   18   11   26   45   46                                       
CONECT   19   16   20   25   25                                       
CONECT   20   19   21   21   47                                       
CONECT   21   20   20   22   23                                       
CONECT   22   21                                                      
CONECT   23   21   48   24   24                                       
CONECT   24   23   23   49   25                                       
CONECT   25   19   19   24   50                                       
CONECT   26   18    9   27   51                                       
CONECT   27   26   10   52   28                                       
CONECT   28   11   27   53   54                                       
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   20                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   14                                                      
CONECT   56   13                                                      
CONECT   57   13                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
