COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      11.598  -2.298   0.669  1.00  0.00           C  
HETATM    2  C   UNL     1      11.369  -1.044  -0.177  1.00  0.00           C  
HETATM    3  C   UNL     1      13.018  -1.099  -1.916  1.00  0.00           C  
HETATM    4  C   UNL     1       9.933  -0.606  -0.049  1.00  0.00           C  
HETATM    5  C   UNL     1       9.603   0.431   0.807  1.00  0.00           C  
HETATM    6  C   UNL     1       8.291   0.837   0.930  1.00  0.00           C  
HETATM    7  C   UNL     1       7.293   0.199   0.188  1.00  0.00           C  
HETATM    8  O   UNL     1      10.658  -3.306   0.290  1.00  0.00           O  
HETATM    9  O   UNL     1      11.658  -1.334  -1.546  1.00  0.00           O  
HETATM   10  C   UNL     1       5.928   0.611   0.314  1.00  0.00           C  
HETATM   11  C   UNL     1       4.808   0.949   0.418  1.00  0.00           C  
HETATM   12  C   UNL     1       3.443   1.362   0.545  1.00  0.00           C  
HETATM   13  C   UNL     1       3.105   2.409   1.408  1.00  0.00           C  
HETATM   14  C   UNL     1       1.803   2.802   1.529  1.00  0.00           C  
HETATM   15  C   UNL     1       0.807   2.157   0.789  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.601   2.583   0.919  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.561   1.962   0.206  1.00  0.00           N  
HETATM   18  C   UNL     1      -2.958   2.384   0.335  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.820   1.609  -0.664  1.00  0.00           C  
HETATM   20  N   UNL     1      -5.199   2.116  -0.634  1.00  0.00           N  
HETATM   21  C   UNL     1      -5.582   3.372  -0.939  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.019   3.787  -0.754  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.324   4.801   0.350  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.390   5.226  -1.118  1.00  0.00           C  
HETATM   25  O   UNL     1      -4.770   4.167  -1.362  1.00  0.00           O  
HETATM   26  C   UNL     1      -6.095   1.022  -0.215  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.337  -0.276  -0.586  1.00  0.00           C  
HETATM   28  N   UNL     1      -5.772  -1.396   0.252  1.00  0.00           N  
HETATM   29  C   UNL     1      -6.846  -2.129  -0.107  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.294  -3.281   0.755  1.00  0.00           C  
HETATM   31  N   UNL     1      -8.669  -3.702   0.383  1.00  0.00           N  
HETATM   32  C   UNL     1      -8.769  -5.099   0.877  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.391  -5.721   0.567  1.00  0.00           C  
HETATM   34  F   UNL     1      -7.428  -6.400  -0.655  1.00  0.00           F  
HETATM   35  C   UNL     1      -6.420  -4.525   0.487  1.00  0.00           C  
HETATM   36  O   UNL     1      -7.451  -1.860  -1.123  1.00  0.00           O  
HETATM   37  C   UNL     1      -3.867   0.117  -0.271  1.00  0.00           C  
HETATM   38  O   UNL     1      -0.894   3.493   1.669  1.00  0.00           O  
HETATM   39  C   UNL     1       1.143   1.111  -0.075  1.00  0.00           C  
HETATM   40  C   UNL     1       2.446   0.721  -0.200  1.00  0.00           C  
HETATM   41  C   UNL     1       7.634  -0.847  -0.674  1.00  0.00           C  
HETATM   42  C   UNL     1       8.951  -1.239  -0.790  1.00  0.00           C  
HETATM   43  H   UNL     1      12.611  -2.666   0.507  1.00  0.00           H  
HETATM   44  H   UNL     1      11.464  -2.054   1.723  1.00  0.00           H  
HETATM   45  H   UNL     1      12.025  -0.246   0.171  1.00  0.00           H  
HETATM   46  H   UNL     1      13.156  -1.343  -2.969  1.00  0.00           H  
HETATM   47  H   UNL     1      13.264  -0.050  -1.750  1.00  0.00           H  
HETATM   48  H   UNL     1      13.673  -1.725  -1.309  1.00  0.00           H  
HETATM   49  H   UNL     1      10.375   0.923   1.379  1.00  0.00           H  
HETATM   50  H   UNL     1       8.035   1.646   1.598  1.00  0.00           H  
HETATM   51  H   UNL     1      10.745  -4.131   0.787  1.00  0.00           H  
HETATM   52  H   UNL     1       3.874   2.907   1.980  1.00  0.00           H  
HETATM   53  H   UNL     1       1.542   3.610   2.196  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.328   1.235  -0.393  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.307   2.182   1.348  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.036   3.451   0.130  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.408   1.714  -1.668  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.761   3.012  -0.946  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.267   4.694   0.885  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.486   5.167   0.943  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.595   5.872  -1.492  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.376   5.398  -1.549  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.270   1.066   0.860  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.041   1.079  -0.754  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.458  -0.511  -1.643  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.288  -1.611   1.065  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.250  -3.006   1.809  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.802  -3.661  -0.616  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.958  -5.110   1.951  1.00  0.00           H  
HETATM   70  H   UNL     1      -9.556  -5.635   0.347  1.00  0.00           H  
HETATM   71  H   UNL     1      -7.093  -6.399   1.367  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.973  -4.467  -0.505  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.645  -4.615   1.248  1.00  0.00           H  
HETATM   74  H   UNL     1      -3.173  -0.467  -0.875  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.654  -0.006   0.791  1.00  0.00           H  
HETATM   76  H   UNL     1       0.373   0.613  -0.646  1.00  0.00           H  
HETATM   77  H   UNL     1       2.706  -0.088  -0.867  1.00  0.00           H  
HETATM   78  H   UNL     1       6.868  -1.345  -1.250  1.00  0.00           H  
HETATM   79  H   UNL     1       9.216  -2.047  -1.456  1.00  0.00           H  
CONECT    1    8    2   43   44                                       
CONECT    2    4    1    9   45                                       
CONECT    3    9   46   47   48                                       
CONECT    4   42   42    5    2                                       
CONECT    5    6    6    4   49                                       
CONECT    6    7    5    5   50                                       
CONECT    7   10   41   41    6                                       
CONECT    8    1   51                                                 
CONECT    9    2    3                                                 
CONECT   10   11   11   11    7                                       
CONECT   11   12   10   10   10                                       
CONECT   12   40   40   13   11                                       
CONECT   13   14   14   12   52                                       
CONECT   14   15   13   13   53                                       
CONECT   15   16   39   39   14                                       
CONECT   16   17   38   38   15                                       
CONECT   17   18   16   54                                            
CONECT   18   19   17   55   56                                       
CONECT   19   37   20   18   57                                       
CONECT   20   26   19   21                                            
CONECT   21   20   25   25   22                                       
CONECT   22   21   24   23   58                                       
CONECT   23   22   24   59   60                                       
CONECT   24   22   23   61   62                                       
CONECT   25   21   21                                                 
CONECT   26   27   20   63   64                                       
CONECT   27   28   26   37   65                                       
CONECT   28   29   27   66                                            
CONECT   29   30   36   36   28                                       
CONECT   30   31   29   35   67                                       
CONECT   31   32   30   68                                            
CONECT   32   31   33   69   70                                       
CONECT   33   32   35   34   71                                       
CONECT   34   33                                                      
CONECT   35   30   33   72   73                                       
CONECT   36   29   29                                                 
CONECT   37   27   19   74   75                                       
CONECT   38   16   16                                                 
CONECT   39   15   15   40   76                                       
CONECT   40   39   12   12   77                                       
CONECT   41    7    7   42   78                                       
CONECT   42   41    4    4   79                                       
CONECT   43    1                                                      
CONECT   44    1                                                      
CONECT   45    2                                                      
CONECT   46    3                                                      
CONECT   47    3                                                      
CONECT   48    3                                                      
CONECT   49    5                                                      
CONECT   50    6                                                      
CONECT   51    8                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   24                                                      
CONECT   63   26                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   32                                                      
CONECT   70   32                                                      
CONECT   71   33                                                      
CONECT   72   35                                                      
CONECT   73   35                                                      
CONECT   74   37                                                      
CONECT   75   37                                                      
CONECT   76   39                                                      
CONECT   77   40                                                      
CONECT   78   41                                                      
CONECT   79   42                                                      
MASTER        0    0    0    0    0    0    0    0   79    0   79    0
END
