COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.459  -4.146  -1.871  1.00  0.00           N  
HETATM    2  C   UNL     1       3.787  -3.985  -1.865  1.00  0.00           C  
HETATM    3  C   UNL     1       4.370  -2.956  -1.221  1.00  0.00           C  
HETATM    4  C   UNL     1       1.663  -3.300  -1.244  1.00  0.00           C  
HETATM    5  C   UNL     1       2.223  -2.205  -0.554  1.00  0.00           C  
HETATM    6  N   UNL     1       3.593  -2.041  -0.549  1.00  0.00           N  
HETATM    7  C   UNL     1       3.861  -0.936   0.171  1.00  0.00           C  
HETATM    8  N   UNL     1       2.745  -0.411   0.607  1.00  0.00           N  
HETATM    9  C   UNL     1       1.703  -1.151   0.191  1.00  0.00           C  
HETATM   10  C   UNL     1       5.239  -0.385   0.435  1.00  0.00           C  
HETATM   11  N   UNL     1       0.291  -3.486  -1.263  1.00  0.00           N  
HETATM   12  C   UNL     1       5.338   1.037  -0.127  1.00  0.00           C  
HETATM   13  C   UNL     1       6.907   0.175   2.211  1.00  0.00           C  
HETATM   14  C   UNL     1       7.025   1.603   1.670  1.00  0.00           C  
HETATM   15  N   UNL     1       6.638   1.605   0.252  1.00  0.00           N  
HETATM   16  C   UNL     1       5.496  -0.353   1.943  1.00  0.00           C  
HETATM   17  C   UNL     1       0.276  -0.894   0.473  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.166  -0.773   1.796  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.498  -0.534   2.054  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.402  -0.413   0.994  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.953  -0.535  -0.325  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.632  -0.766  -0.582  1.00  0.00           C  
HETATM   23  F   UNL     1       0.712  -0.892   2.816  1.00  0.00           F  
HETATM   24  C   UNL     1      -3.828  -0.157   1.267  1.00  0.00           C  
HETATM   25  O   UNL     1      -4.219  -0.051   2.414  1.00  0.00           O  
HETATM   26  N   UNL     1      -4.700  -0.040   0.245  1.00  0.00           N  
HETATM   27  C   UNL     1      -6.025   0.305   0.496  1.00  0.00           C  
HETATM   28  N   UNL     1      -6.447   0.422   1.745  1.00  0.00           N  
HETATM   29  C   UNL     1      -7.695   0.746   2.027  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.611   0.978   1.020  1.00  0.00           C  
HETATM   31  C   UNL     1      -8.208   0.865  -0.304  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.893   0.529  -0.568  1.00  0.00           C  
HETATM   33  C   UNL     1      -9.181   1.111  -1.429  1.00  0.00           C  
HETATM   34  F   UNL     1      -9.293  -0.045  -2.209  1.00  0.00           F  
HETATM   35  F   UNL     1     -10.434   1.439  -0.898  1.00  0.00           F  
HETATM   36  F   UNL     1      -8.720   2.167  -2.222  1.00  0.00           F  
HETATM   37  C   UNL     1       6.094   2.528   2.456  1.00  0.00           C  
HETATM   38  C   UNL     1       7.462   2.118  -0.683  1.00  0.00           C  
HETATM   39  O   UNL     1       8.533   2.585  -0.358  1.00  0.00           O  
HETATM   40  C   UNL     1       7.052   2.113  -2.133  1.00  0.00           C  
HETATM   41  C   UNL     1       8.029   2.712  -3.147  1.00  0.00           C  
HETATM   42  C   UNL     1       6.745   3.462  -2.786  1.00  0.00           C  
HETATM   43  H   UNL     1       4.407  -4.697  -2.389  1.00  0.00           H  
HETATM   44  H   UNL     1       5.445  -2.850  -1.231  1.00  0.00           H  
HETATM   45  H   UNL     1       5.983  -1.020  -0.048  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.100  -4.149  -1.853  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.279  -2.953  -0.687  1.00  0.00           H  
HETATM   48  H   UNL     1       5.254   1.008  -1.213  1.00  0.00           H  
HETATM   49  H   UNL     1       4.535   1.649   0.285  1.00  0.00           H  
HETATM   50  H   UNL     1       7.635  -0.464   1.712  1.00  0.00           H  
HETATM   51  H   UNL     1       7.098   0.175   3.284  1.00  0.00           H  
HETATM   52  H   UNL     1       8.054   1.949   1.771  1.00  0.00           H  
HETATM   53  H   UNL     1       4.766   0.301   2.422  1.00  0.00           H  
HETATM   54  H   UNL     1       5.402  -1.360   2.349  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.843  -0.440   3.073  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.652  -0.441  -1.143  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.289  -0.855  -1.602  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.403  -0.196  -0.665  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.003   0.832   3.058  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.630   1.243   1.260  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.545   0.437  -1.586  1.00  0.00           H  
HETATM   62  H   UNL     1       6.374   2.515   3.510  1.00  0.00           H  
HETATM   63  H   UNL     1       6.179   3.544   2.070  1.00  0.00           H  
HETATM   64  H   UNL     1       5.065   2.184   2.350  1.00  0.00           H  
HETATM   65  H   UNL     1       6.461   1.254  -2.451  1.00  0.00           H  
HETATM   66  H   UNL     1       8.969   3.110  -2.764  1.00  0.00           H  
HETATM   67  H   UNL     1       8.081   2.247  -4.131  1.00  0.00           H  
HETATM   68  H   UNL     1       5.952   3.491  -3.534  1.00  0.00           H  
HETATM   69  H   UNL     1       6.840   4.354  -2.167  1.00  0.00           H  
CONECT    1    2    4    4                                            
CONECT    2    3    3    1   43                                       
CONECT    3    2    2    6   44                                       
CONECT    4    1    1    5   11                                       
CONECT    5    6    4    9    9                                       
CONECT    6    3    7    5                                            
CONECT    7   10    6    8    8                                       
CONECT    8    7    7    9                                            
CONECT    9    5    5    8   17                                       
CONECT   10   12    7   16   45                                       
CONECT   11    4   46   47                                            
CONECT   12   15   10   48   49                                       
CONECT   13   14   16   50   51                                       
CONECT   14   15   13   37   52                                       
CONECT   15   38   12   14                                            
CONECT   16   10   13   53   54                                       
CONECT   17    9   18   18   22                                       
CONECT   18   23   17   17   19                                       
CONECT   19   18   20   20   55                                       
CONECT   20   19   19   21   24                                       
CONECT   21   22   22   20   56                                       
CONECT   22   17   21   21   57                                       
CONECT   23   18                                                      
CONECT   24   20   25   25   26                                       
CONECT   25   24   24                                                 
CONECT   26   24   27   58                                            
CONECT   27   26   28   28   32                                       
CONECT   28   27   27   29                                            
CONECT   29   28   30   30   59                                       
CONECT   30   29   29   31   60                                       
CONECT   31   32   32   30   33                                       
CONECT   32   27   31   31   61                                       
CONECT   33   31   34   35   36                                       
CONECT   34   33                                                      
CONECT   35   33                                                      
CONECT   36   33                                                      
CONECT   37   14   62   63   64                                       
CONECT   38   39   39   40   15                                       
CONECT   39   38   38                                                 
CONECT   40   41   42   38   65                                       
CONECT   41   42   40   66   67                                       
CONECT   42   41   40   68   69                                       
CONECT   43    2                                                      
CONECT   44    3                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   19                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   26                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   32                                                      
CONECT   62   37                                                      
CONECT   63   37                                                      
CONECT   64   37                                                      
CONECT   65   40                                                      
CONECT   66   41                                                      
CONECT   67   41                                                      
CONECT   68   42                                                      
CONECT   69   42                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
