COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.615  -0.860   0.817  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.159  -0.360   1.362  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.109  -0.211   0.343  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.701   0.252  -0.934  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.354   0.556  -1.162  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.855  -0.054   1.121  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.681   0.392  -1.938  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.971   0.078  -1.644  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.475  -0.510   0.547  1.00  0.00           C  
HETATM   10  C   UNL     1       4.019   4.390   1.621  1.00  0.00           C  
HETATM   11  C   UNL     1       2.221  -2.625   0.033  1.00  0.00           C  
HETATM   12  C   UNL     1       3.429   4.086   0.242  1.00  0.00           C  
HETATM   13  C   UNL     1       4.486   3.412  -0.634  1.00  0.00           C  
HETATM   14  C   UNL     1       2.233   3.180   0.360  1.00  0.00           C  
HETATM   15  C   UNL     1       2.169   2.243   1.377  1.00  0.00           C  
HETATM   16  C   UNL     1       1.072   1.410   1.490  1.00  0.00           C  
HETATM   17  C   UNL     1       0.033   1.491   0.576  1.00  0.00           C  
HETATM   18  C   UNL     1       0.097   2.419  -0.438  1.00  0.00           C  
HETATM   19  C   UNL     1       1.194   3.261  -0.550  1.00  0.00           C  
HETATM   20  C   UNL     1       1.224   4.252  -1.686  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.133   0.551   0.724  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.100   0.705  -0.355  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.443   0.399  -0.137  1.00  0.00           C  
HETATM   24  N   UNL     1      -8.333  -0.354  -0.443  1.00  0.00           N  
HETATM   25  O   UNL     1      -0.828  -1.494   1.843  1.00  0.00           O  
HETATM   26  N   UNL     1       0.072  -1.456  -0.194  1.00  0.00           N  
HETATM   27  C   UNL     1       0.727  -2.735   0.164  1.00  0.00           C  
HETATM   28  C   UNL     1       2.957  -3.789  -0.157  1.00  0.00           C  
HETATM   29  C   UNL     1       4.339  -3.735  -0.264  1.00  0.00           C  
HETATM   30  C   UNL     1       4.987  -2.518  -0.186  1.00  0.00           C  
HETATM   31  C   UNL     1       4.256  -1.348  -0.019  1.00  0.00           C  
HETATM   32  C   UNL     1       2.877  -1.411   0.107  1.00  0.00           C  
HETATM   33  N   UNL     1       4.959  -0.126   0.048  1.00  0.00           N  
HETATM   34  O   UNL     1       4.957   2.183  -0.043  1.00  0.00           O  
HETATM   35  C   UNL     1       4.342   1.021  -0.349  1.00  0.00           C  
HETATM   36  O   UNL     1       3.298   1.007  -0.972  1.00  0.00           O  
HETATM   37  C   UNL     1       0.185  -0.919  -1.552  1.00  0.00           C  
HETATM   38  O   UNL     1       2.319  -4.988  -0.238  1.00  0.00           O  
HETATM   39  F   UNL     1       5.049  -4.870  -0.445  1.00  0.00           F  
HETATM   40  N   UNL     1      -7.910  -0.965   1.779  1.00  0.00           N  
HETATM   41  H   UNL     1      -5.461  -0.713   2.337  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.031   0.910  -2.130  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.126  -0.171   1.910  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.411   0.742  -2.924  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.724   0.184  -2.412  1.00  0.00           H  
HETATM   46  H   UNL     1       4.329   3.460   2.096  1.00  0.00           H  
HETATM   47  H   UNL     1       4.882   5.047   1.510  1.00  0.00           H  
HETATM   48  H   UNL     1       3.266   4.880   2.238  1.00  0.00           H  
HETATM   49  H   UNL     1       3.143   5.038  -0.215  1.00  0.00           H  
HETATM   50  H   UNL     1       4.063   3.202  -1.617  1.00  0.00           H  
HETATM   51  H   UNL     1       5.332   4.094  -0.758  1.00  0.00           H  
HETATM   52  H   UNL     1       2.971   2.134   2.091  1.00  0.00           H  
HETATM   53  H   UNL     1       1.024   0.689   2.292  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.700   2.511  -1.162  1.00  0.00           H  
HETATM   55  H   UNL     1       0.759   5.185  -1.367  1.00  0.00           H  
HETATM   56  H   UNL     1       2.257   4.441  -1.976  1.00  0.00           H  
HETATM   57  H   UNL     1       0.676   3.846  -2.537  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.642   0.791   1.675  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.809   1.019  -1.226  1.00  0.00           H  
HETATM   60  H   UNL     1       0.359  -3.516  -0.504  1.00  0.00           H  
HETATM   61  H   UNL     1       0.474  -2.998   1.191  1.00  0.00           H  
HETATM   62  H   UNL     1       6.065  -2.475  -0.259  1.00  0.00           H  
HETATM   63  H   UNL     1       2.316  -0.505   0.284  1.00  0.00           H  
HETATM   64  H   UNL     1       5.880  -0.103   0.375  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.363   0.021  -1.617  1.00  0.00           H  
HETATM   66  H   UNL     1       1.235  -0.745  -1.787  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.233  -1.633  -2.261  1.00  0.00           H  
HETATM   68  H   UNL     1       2.063  -5.237  -1.137  1.00  0.00           H  
HETATM   69  H   UNL     1      -7.277  -1.079   2.505  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.848  -1.170   1.917  1.00  0.00           H  
CONECT    1   25   25   26   21                                       
CONECT    2    6    3    3   41                                       
CONECT    3    2    2    4    9                                       
CONECT    4    5    5    3    7                                       
CONECT    5   23    4    4   42                                       
CONECT    6   23   23    2   43                                       
CONECT    7    4    8    8   44                                       
CONECT    8    7    7   24   45                                       
CONECT    9    3   40   24   24                                       
CONECT   10   12   46   47   48                                       
CONECT   11   28   28   32   27                                       
CONECT   12   13   14   10   49                                       
CONECT   13   34   12   50   51                                       
CONECT   14   19   12   15   15                                       
CONECT   15   14   14   16   52                                       
CONECT   16   17   17   15   53                                       
CONECT   17   18   21   16   16                                       
CONECT   18   19   19   17   54                                       
CONECT   19   20   18   18   14                                       
CONECT   20   19   55   56   57                                       
CONECT   21    1   22   17   58                                       
CONECT   22   21   23   59                                            
CONECT   23   22    6    6    5                                       
CONECT   24    9    9    8                                            
CONECT   25    1    1                                                 
CONECT   26   27    1   37                                            
CONECT   27   11   26   60   61                                       
CONECT   28   29   38   11   11                                       
CONECT   29   39   30   30   28                                       
CONECT   30   29   29   31   62                                       
CONECT   31   30   33   32   32                                       
CONECT   32   31   31   11   63                                       
CONECT   33   31   35   64                                            
CONECT   34   35   13                                                 
CONECT   35   33   34   36   36                                       
CONECT   36   35   35                                                 
CONECT   37   26   65   66   67                                       
CONECT   38   28   68                                                 
CONECT   39   29                                                      
CONECT   40    9   69   70                                            
CONECT   41    2                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   18                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   27                                                      
CONECT   61   27                                                      
CONECT   62   30                                                      
CONECT   63   32                                                      
CONECT   64   33                                                      
CONECT   65   37                                                      
CONECT   66   37                                                      
CONECT   67   37                                                      
CONECT   68   38                                                      
CONECT   69   40                                                      
CONECT   70   40                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
