COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.382   8.906  -0.578  1.00  0.00           C  
HETATM    2  C   UNL     1       7.845   8.130   0.469  1.00  0.00           C  
HETATM    3  C   UNL     1       8.213   6.808   0.285  1.00  0.00           C  
HETATM    4  C   UNL     1       8.116   6.246  -0.988  1.00  0.00           C  
HETATM    5  C   UNL     1       7.652   7.014  -2.056  1.00  0.00           C  
HETATM    6  C   UNL     1       7.285   8.344  -1.851  1.00  0.00           C  
HETATM    7  C   UNL     1       7.950   8.740   1.850  1.00  0.00           C  
HETATM    8  N   UNL     1       6.895   9.699   2.087  1.00  0.00           N  
HETATM    9  C   UNL     1       5.642   9.358   2.608  1.00  0.00           C  
HETATM   10  C   UNL     1       4.677  10.434   2.765  1.00  0.00           C  
HETATM   11  C   UNL     1       4.746  11.558   1.941  1.00  0.00           C  
HETATM   12  C   UNL     1       3.818  12.566   2.109  1.00  0.00           C  
HETATM   13  C   UNL     1       2.825  12.500   3.065  1.00  0.00           C  
HETATM   14  C   UNL     1       2.757  11.376   3.889  1.00  0.00           C  
HETATM   15  C   UNL     1       3.682  10.343   3.739  1.00  0.00           C  
HETATM   16  N   UNL     1       1.738  11.283   4.885  1.00  0.00           N  
HETATM   17  S   UNL     1       0.233  10.576   4.419  1.00  0.00           S  
HETATM   18  C   UNL     1      -0.669  12.006   3.863  1.00  0.00           C  
HETATM   19  C   UNL     1       1.706  12.339   5.937  1.00  0.00           C  
HETATM   20  O   UNL     1       5.340   8.190   2.911  1.00  0.00           O  
HETATM   21  O   UNL     1      -0.453  10.079   5.598  1.00  0.00           O  
HETATM   22  O   UNL     1       0.427   9.711   3.271  1.00  0.00           O  
HETATM   23  C   UNL     1       9.312   9.384   2.104  1.00  0.00           C  
HETATM   24  F   UNL     1       7.558   6.474  -3.278  1.00  0.00           F  
HETATM   25  C   UNL     1       3.891  13.761   1.231  1.00  0.00           C  
HETATM   26  O   UNL     1       4.407  13.435   0.014  1.00  0.00           O  
HETATM   27  O   UNL     1       3.530  14.874   1.583  1.00  0.00           O  
HETATM   28  C   UNL     1       4.528  14.502  -0.918  1.00  0.00           C  
HETATM   29  C   UNL     1       5.120  14.037  -2.266  1.00  0.00           C  
HETATM   30  N   UNL     1       4.234  12.978  -2.792  1.00  0.00           N  
HETATM   31  C   UNL     1       5.054  15.212  -3.265  1.00  0.00           C  
HETATM   32  C   UNL     1       6.544  13.422  -2.133  1.00  0.00           C  
HETATM   33  C   UNL     1       9.624  16.077  -0.794  1.00  0.00           C  
HETATM   34  C   UNL     1       8.884  15.342   0.133  1.00  0.00           C  
HETATM   35  C   UNL     1       7.881  14.477  -0.303  1.00  0.00           C  
HETATM   36  C   UNL     1       7.632  14.360  -1.660  1.00  0.00           C  
HETATM   37  C   UNL     1       8.356  15.082  -2.593  1.00  0.00           C  
HETATM   38  C   UNL     1       9.359  15.947  -2.157  1.00  0.00           C  
HETATM   39  O   UNL     1       3.735  15.735  -3.359  1.00  0.00           O  
HETATM   40  H   UNL     1       7.094   9.944  -0.428  1.00  0.00           H  
HETATM   41  H   UNL     1       8.576   6.203   1.111  1.00  0.00           H  
HETATM   42  H   UNL     1       8.401   5.211  -1.148  1.00  0.00           H  
HETATM   43  H   UNL     1       6.923   8.942  -2.683  1.00  0.00           H  
HETATM   44  H   UNL     1       7.806   7.954   2.602  1.00  0.00           H  
HETATM   45  H   UNL     1       7.068  10.656   1.797  1.00  0.00           H  
HETATM   46  H   UNL     1       5.522  11.629   1.182  1.00  0.00           H  
HETATM   47  H   UNL     1       2.103  13.304   3.182  1.00  0.00           H  
HETATM   48  H   UNL     1       3.628   9.467   4.382  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.421  12.845   4.515  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.374  12.221   2.835  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.736  11.783   3.916  1.00  0.00           H  
HETATM   52  H   UNL     1       1.465  13.307   5.489  1.00  0.00           H  
HETATM   53  H   UNL     1       2.679  12.411   6.430  1.00  0.00           H  
HETATM   54  H   UNL     1       0.949  12.101   6.689  1.00  0.00           H  
HETATM   55  H   UNL     1       9.214  10.464   2.260  1.00  0.00           H  
HETATM   56  H   UNL     1       9.780   8.953   2.997  1.00  0.00           H  
HETATM   57  H   UNL     1      10.003   9.224   1.269  1.00  0.00           H  
HETATM   58  H   UNL     1       5.162  15.267  -0.459  1.00  0.00           H  
HETATM   59  H   UNL     1       3.536  14.952  -1.050  1.00  0.00           H  
HETATM   60  H   UNL     1       3.560  13.246  -3.465  1.00  0.00           H  
HETATM   61  H   UNL     1       4.221  12.117  -2.306  1.00  0.00           H  
HETATM   62  H   UNL     1       5.722  16.027  -2.959  1.00  0.00           H  
HETATM   63  H   UNL     1       5.366  14.893  -4.266  1.00  0.00           H  
HETATM   64  H   UNL     1       6.519  12.561  -1.450  1.00  0.00           H  
HETATM   65  H   UNL     1       6.860  12.995  -3.096  1.00  0.00           H  
HETATM   66  H   UNL     1      10.405  16.751  -0.454  1.00  0.00           H  
HETATM   67  H   UNL     1       9.935  16.519  -2.879  1.00  0.00           H  
HETATM   68  H   UNL     1       8.157  14.987  -3.658  1.00  0.00           H  
HETATM   69  H   UNL     1       7.310  13.909   0.426  1.00  0.00           H  
HETATM   70  H   UNL     1       9.090  15.444   1.195  1.00  0.00           H  
HETATM   71  H   UNL     1       3.214  15.088  -3.861  1.00  0.00           H  
CONECT    1    2    6    6   40                                       
CONECT    2    1    7    3    3                                       
CONECT    3    2    2    4   41                                       
CONECT    4    3    5    5   42                                       
CONECT    5    4    4    6   24                                       
CONECT    6    1    1    5   43                                       
CONECT    7    2    8   23   44                                       
CONECT    8    7    9   45                                            
CONECT    9    8   10   20   20                                       
CONECT   10    9   15   15   11                                       
CONECT   11   10   12   12   46                                       
CONECT   12   11   11   13   25                                       
CONECT   13   12   14   14   47                                       
CONECT   14   13   13   16   15                                       
CONECT   15   10   10   14   48                                       
CONECT   16   14   19   17                                            
CONECT   17   16   18   22   22                                       
CONECT   17   21   21                                                 
CONECT   18   17   49   50   51                                       
CONECT   19   16   52   53   54                                       
CONECT   20    9    9                                                 
CONECT   21   17   17                                                 
CONECT   22   17   17                                                 
CONECT   23    7   55   56   57                                       
CONECT   24    5                                                      
CONECT   25   12   27   27   26                                       
CONECT   26   25   28                                                 
CONECT   27   25   25                                                 
CONECT   28   26   29   58   59                                       
CONECT   29   28   32   31   30                                       
CONECT   30   29   60   61                                            
CONECT   31   29   39   62   63                                       
CONECT   32   29   36   64   65                                       
CONECT   33   38   34   34   66                                       
CONECT   34   33   33   35   70                                       
CONECT   35   34   36   36   69                                       
CONECT   36   32   35   35   37                                       
CONECT   37   36   38   38   68                                       
CONECT   38   33   37   37   67                                       
CONECT   39   31   71                                                 
CONECT   40    1                                                      
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46   11                                                      
CONECT   47   13                                                      
CONECT   48   15                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   23                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
CONECT   66   33                                                      
CONECT   67   38                                                      
CONECT   68   37                                                      
CONECT   69   35                                                      
CONECT   70   34                                                      
CONECT   71   39                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
