COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.003  -2.224  -4.345  1.00  0.00           C  
HETATM    2  C   UNL     1       4.225  -1.172  -3.290  1.00  0.00           C  
HETATM    3  C   UNL     1       3.396  -1.511  -2.049  1.00  0.00           C  
HETATM    4  C   UNL     1       3.621  -0.442  -0.978  1.00  0.00           C  
HETATM    5  C   UNL     1       3.017   0.240   1.265  1.00  0.00           C  
HETATM    6  C   UNL     1       1.793   0.258   2.183  1.00  0.00           C  
HETATM    7  C   UNL     1       4.244  -0.103   2.071  1.00  0.00           C  
HETATM    8  C   UNL     1       4.515  -1.420   2.391  1.00  0.00           C  
HETATM    9  C   UNL     1       5.643  -1.734   3.126  1.00  0.00           C  
HETATM   10  C   UNL     1       6.500  -0.732   3.539  1.00  0.00           C  
HETATM   11  C   UNL     1       6.230   0.585   3.218  1.00  0.00           C  
HETATM   12  C   UNL     1       5.102   0.900   2.484  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.083  -0.582   0.883  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.699   0.806  -0.136  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.065   1.914   0.343  1.00  0.00           C  
HETATM   16  C   UNL     1       0.149   1.728   1.149  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.947   0.946  -0.969  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.878  -1.619  -0.372  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.896  -2.090   0.634  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.065  -1.401   1.823  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.001  -1.835   2.747  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.765  -2.955   2.482  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.596  -3.642   1.294  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.666  -3.207   0.368  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.483  -3.957  -0.925  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.588   3.272   0.057  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.954   4.082  -0.885  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.449   5.351  -1.147  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.571   5.811  -0.472  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.199   5.008   0.462  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.717   3.741   0.726  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.398   7.439  -2.283  1.00  0.00           C  
HETATM   33  F   UNL     1      -3.743  -3.102  -2.001  1.00  0.00           F  
HETATM   34  F   UNL     1      -2.168  -4.427  -1.010  1.00  0.00           F  
HETATM   35  F   UNL     1      -4.368  -5.040  -0.966  1.00  0.00           F  
HETATM   36  F   UNL     1      -2.317  -0.306   2.082  1.00  0.00           F  
HETATM   37  F   UNL     1       0.139   3.632  -1.540  1.00  0.00           F  
HETATM   38  N   UNL     1       2.825  -0.767   0.213  1.00  0.00           N  
HETATM   39  N   UNL     1      -1.194  -0.432   0.144  1.00  0.00           N  
HETATM   40  N   UNL     1       0.585   0.473   1.382  1.00  0.00           N  
HETATM   41  O   UNL     1       4.632  -2.133  -5.527  1.00  0.00           O  
HETATM   42  O   UNL     1       3.262  -3.153  -4.126  1.00  0.00           O  
HETATM   43  O   UNL     1       0.749   2.688   1.597  1.00  0.00           O  
HETATM   44  O   UNL     1       0.327  -1.704   1.112  1.00  0.00           O  
HETATM   45  O   UNL     1      -0.834   6.144  -2.064  1.00  0.00           O  
HETATM   46  H   UNL     1       5.281  -1.141  -3.024  1.00  0.00           H  
HETATM   47  H   UNL     1       3.919  -0.200  -3.677  1.00  0.00           H  
HETATM   48  H   UNL     1       2.339  -1.541  -2.316  1.00  0.00           H  
HETATM   49  H   UNL     1       3.701  -2.483  -1.663  1.00  0.00           H  
HETATM   50  H   UNL     1       4.678  -0.411  -0.712  1.00  0.00           H  
HETATM   51  H   UNL     1       3.316   0.530  -1.365  1.00  0.00           H  
HETATM   52  H   UNL     1       3.144   1.222   0.810  1.00  0.00           H  
HETATM   53  H   UNL     1       1.717  -0.695   2.706  1.00  0.00           H  
HETATM   54  H   UNL     1       1.895   1.064   2.909  1.00  0.00           H  
HETATM   55  H   UNL     1       3.845  -2.203   2.069  1.00  0.00           H  
HETATM   56  H   UNL     1       5.854  -2.763   3.377  1.00  0.00           H  
HETATM   57  H   UNL     1       7.381  -0.978   4.114  1.00  0.00           H  
HETATM   58  H   UNL     1       6.900   1.368   3.540  1.00  0.00           H  
HETATM   59  H   UNL     1       4.892   1.928   2.230  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.238   1.996  -1.015  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.756   0.578  -1.976  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.752   0.366  -0.517  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.150  -2.411  -0.549  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.380  -1.372  -1.308  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.133  -1.298   3.675  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.495  -3.293   3.202  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.194  -4.518   1.088  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.955   6.799  -0.678  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.071   5.372   0.984  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.214   3.115   1.453  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.426   7.333  -2.629  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.384   8.004  -1.351  1.00  0.00           H  
HETATM   73  H   UNL     1      -0.813   7.967  -3.037  1.00  0.00           H  
HETATM   74  H   UNL     1       1.849  -0.865  -0.020  1.00  0.00           H  
HETATM   75  H   UNL     1       4.458  -2.832  -6.173  1.00  0.00           H  
CONECT    1   42   42   41    2                                       
CONECT    2    1    3   46   47                                       
CONECT    3    2    4   48   49                                       
CONECT    4    3   38   50   51                                       
CONECT    5   38    7    6   52                                       
CONECT    6    5   40   53   54                                       
CONECT    7    8    8   12    5                                       
CONECT    8    9    7    7   55                                       
CONECT    9   10   10    8   56                                       
CONECT   10    9    9   11   57                                       
CONECT   11   10   12   12   58                                       
CONECT   12   11   11    7   59                                       
CONECT   13   44   44   40   39                                       
CONECT   14   39   15   15   17                                       
CONECT   15   16   14   14   26                                       
CONECT   16   40   43   43   15                                       
CONECT   17   14   60   61   62                                       
CONECT   18   19   39   63   64                                       
CONECT   19   20   20   24   18                                       
CONECT   20   21   36   19   19                                       
CONECT   21   22   22   20   65                                       
CONECT   22   21   21   23   66                                       
CONECT   23   22   24   24   67                                       
CONECT   24   23   23   19   25                                       
CONECT   25   24   34   33   35                                       
CONECT   26   15   27   31   31                                       
CONECT   27   37   28   28   26                                       
CONECT   28   45   27   27   29                                       
CONECT   29   28   30   30   68                                       
CONECT   30   29   29   31   69                                       
CONECT   31   26   26   30   70                                       
CONECT   32   45   71   72   73                                       
CONECT   33   25                                                      
CONECT   34   25                                                      
CONECT   35   25                                                      
CONECT   36   20                                                      
CONECT   37   27                                                      
CONECT   38    4    5   74                                            
CONECT   39   13   18   14                                            
CONECT   40    6   13   16                                            
CONECT   41    1   75                                                 
CONECT   42    1    1                                                 
CONECT   43   16   16                                                 
CONECT   44   13   13                                                 
CONECT   45   32   28                                                 
CONECT   46    2                                                      
CONECT   47    2                                                      
CONECT   48    3                                                      
CONECT   49    3                                                      
CONECT   50    4                                                      
CONECT   51    4                                                      
CONECT   52    5                                                      
CONECT   53    6                                                      
CONECT   54    6                                                      
CONECT   55    8                                                      
CONECT   56    9                                                      
CONECT   57   10                                                      
CONECT   58   11                                                      
CONECT   59   12                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   17                                                      
CONECT   63   18                                                      
CONECT   64   18                                                      
CONECT   65   21                                                      
CONECT   66   22                                                      
CONECT   67   23                                                      
CONECT   68   29                                                      
CONECT   69   30                                                      
CONECT   70   31                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
CONECT   73   32                                                      
CONECT   74   38                                                      
CONECT   75   41                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
