COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.835  -0.544   2.236  1.00  0.00           O  
HETATM    2  C   UNL     1       2.538  -0.214   1.298  1.00  0.00           C  
HETATM    3  N   UNL     1       2.738  -1.066   0.273  1.00  0.00           N  
HETATM    4  C   UNL     1       2.019  -2.266   0.210  1.00  0.00           C  
HETATM    5  C   UNL     1       2.605  -3.390  -0.339  1.00  0.00           C  
HETATM    6  C   UNL     1       1.880  -4.585  -0.398  1.00  0.00           C  
HETATM    7  C   UNL     1       2.175  -5.925  -0.896  1.00  0.00           C  
HETATM    8  N   UNL     1       1.121  -6.664  -0.698  1.00  0.00           N  
HETATM    9  N   UNL     1       0.112  -5.910  -0.090  1.00  0.00           N  
HETATM   10  C   UNL     1       0.564  -4.629   0.101  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.003  -3.480   0.649  1.00  0.00           C  
HETATM   12  C   UNL     1       0.716  -2.322   0.706  1.00  0.00           C  
HETATM   13  C   UNL     1       3.140   1.068   1.281  1.00  0.00           C  
HETATM   14  C   UNL     1       2.348   2.300   0.894  1.00  0.00           C  
HETATM   15  N   UNL     1       3.066   3.586   0.908  1.00  0.00           N  
HETATM   16  C   UNL     1       4.367   3.592   1.260  1.00  0.00           C  
HETATM   17  O   UNL     1       4.968   4.648   1.274  1.00  0.00           O  
HETATM   18  N   UNL     1       5.018   2.471   1.594  1.00  0.00           N  
HETATM   19  C   UNL     1       4.437   1.234   1.615  1.00  0.00           C  
HETATM   20  C   UNL     1       5.259   0.035   2.013  1.00  0.00           C  
HETATM   21  C   UNL     1       1.806   2.086  -0.495  1.00  0.00           C  
HETATM   22  C   UNL     1       0.558   1.525  -0.666  1.00  0.00           C  
HETATM   23  C   UNL     1       0.055   1.327  -1.954  1.00  0.00           C  
HETATM   24  C   UNL     1       0.822   1.700  -3.062  1.00  0.00           C  
HETATM   25  F   UNL     1       0.345   1.513  -4.312  1.00  0.00           F  
HETATM   26  C   UNL     1       2.072   2.262  -2.874  1.00  0.00           C  
HETATM   27  C   UNL     1       2.559   2.459  -1.595  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.280   0.726  -2.145  1.00  0.00           C  
HETATM   29  O   UNL     1      -1.675   0.465  -3.265  1.00  0.00           O  
HETATM   30  N   UNL     1      -2.061   0.466  -1.078  1.00  0.00           N  
HETATM   31  C   UNL     1      -3.341  -0.224  -1.257  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.069  -0.283   0.061  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.007   0.709   0.392  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.674   0.622   1.642  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.361  -0.456   2.490  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.437  -1.366   2.076  1.00  0.00           C  
HETATM   37  N   UNL     1      -3.832  -1.264   0.900  1.00  0.00           N  
HETATM   38  C   UNL     1      -5.300   1.776  -0.471  1.00  0.00           C  
HETATM   39  C   UNL     1      -6.218   2.709  -0.097  1.00  0.00           C  
HETATM   40  C   UNL     1      -6.873   2.623   1.130  1.00  0.00           C  
HETATM   41  C   UNL     1      -6.613   1.602   1.994  1.00  0.00           C  
HETATM   42  H   UNL     1       3.381  -0.848  -0.420  1.00  0.00           H  
HETATM   43  H   UNL     1       3.615  -3.346  -0.720  1.00  0.00           H  
HETATM   44  H   UNL     1       3.101  -6.246  -1.348  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.012  -3.508   1.034  1.00  0.00           H  
HETATM   46  H   UNL     1       0.271  -1.438   1.137  1.00  0.00           H  
HETATM   47  H   UNL     1       1.500   2.382   1.574  1.00  0.00           H  
HETATM   48  H   UNL     1       2.612   4.410   0.669  1.00  0.00           H  
HETATM   49  H   UNL     1       5.955   2.541   1.837  1.00  0.00           H  
HETATM   50  H   UNL     1       5.789  -0.348   1.140  1.00  0.00           H  
HETATM   51  H   UNL     1       5.981   0.326   2.776  1.00  0.00           H  
HETATM   52  H   UNL     1       4.604  -0.740   2.409  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.029   1.239   0.194  1.00  0.00           H  
HETATM   54  H   UNL     1       2.665   2.555  -3.727  1.00  0.00           H  
HETATM   55  H   UNL     1       3.535   2.898  -1.454  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.776   0.736  -0.191  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.947   0.318  -1.983  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.161  -1.236  -1.618  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.845  -0.561   3.450  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.192  -2.196   2.721  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.800   1.856  -1.426  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.443   3.530  -0.762  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.596   3.378   1.401  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.128   1.546   2.942  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.766  -6.240   0.157  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1   13    3                                       
CONECT    3    2    4   42                                            
CONECT    4    5    5    3   12                                       
CONECT    5    6    4    4   43                                       
CONECT    6    7    5   10   10                                       
CONECT    7    8    8    6   44                                       
CONECT    8    7    7    9                                            
CONECT    9    8   10   65                                            
CONECT   10    6    6    9   11                                       
CONECT   11   10   12   12   45                                       
CONECT   12    4   11   11   46                                       
CONECT   13   14    2   19   19                                       
CONECT   14   21   15   13   47                                       
CONECT   15   14   16   48                                            
CONECT   16   15   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   49                                            
CONECT   19   13   13   18   20                                       
CONECT   20   19   50   51   52                                       
CONECT   21   27   14   22   22                                       
CONECT   22   21   21   23   53                                       
CONECT   23   24   24   22   28                                       
CONECT   24   26   25   23   23                                       
CONECT   25   24                                                      
CONECT   26   27   27   24   54                                       
CONECT   27   26   26   21   55                                       
CONECT   28   29   29   23   30                                       
CONECT   29   28   28                                                 
CONECT   30   28   31   56                                            
CONECT   31   30   32   57   58                                       
CONECT   32   31   37   37   33                                       
CONECT   33   32   38   38   34                                       
CONECT   34   33   35   41   41                                       
CONECT   35   36   36   34   59                                       
CONECT   36   37   35   35   60                                       
CONECT   37   32   32   36                                            
CONECT   38   33   33   39   61                                       
CONECT   39   38   40   40   62                                       
CONECT   40   39   39   41   63                                       
CONECT   41   34   34   40   64                                       
CONECT   42    3                                                      
CONECT   43    5                                                      
CONECT   44    7                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   18                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   22                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
CONECT   59   35                                                      
CONECT   60   36                                                      
CONECT   61   38                                                      
CONECT   62   39                                                      
CONECT   63   40                                                      
CONECT   64   41                                                      
CONECT   65    9                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
