COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.404  -0.159   0.394  1.00  0.00           C  
HETATM    2  C   UNL     1       3.267   0.411   1.657  1.00  0.00           C  
HETATM    3  C   UNL     1       2.013   0.580   2.212  1.00  0.00           C  
HETATM    4  N   UNL     1       6.431  -0.191  -1.614  1.00  0.00           N  
HETATM    5  C   UNL     1       0.888   0.182   1.503  1.00  0.00           C  
HETATM    6  C   UNL     1       1.022  -0.389   0.241  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.394   0.349   2.041  1.00  0.00           N  
HETATM    8  C   UNL     1       2.272  -0.560  -0.313  1.00  0.00           C  
HETATM    9  C   UNL     1       2.415  -1.180  -1.679  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.530   0.664   3.469  1.00  0.00           C  
HETATM   11  C   UNL     1       0.498   1.751   3.809  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.248  -0.872   1.076  1.00  0.00           N  
HETATM   13  C   UNL     1       1.902   1.191   3.585  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.528   0.218   1.230  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.326  -1.523  -0.259  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.291  -0.586   0.184  1.00  0.00           N  
HETATM   17  N   UNL     1       6.837  -0.937  -0.501  1.00  0.00           N  
HETATM   18  C   UNL     1       8.161  -1.529  -0.299  1.00  0.00           C  
HETATM   19  O   UNL     1      -5.468  -4.132  -0.186  1.00  0.00           O  
HETATM   20  C   UNL     1       5.797  -1.015   0.355  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.114  -2.030   0.952  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.140  -3.066   0.487  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.753  -3.725  -1.355  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.671  -2.715  -0.964  1.00  0.00           C  
HETATM   25  C   UNL     1       4.753  -0.335  -0.200  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.175   0.700  -0.194  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.095   1.222   0.440  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.637   2.652   0.284  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.830   2.967  -0.936  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.057   1.465  -1.148  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.763   3.979  -1.778  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.308   4.335  -1.607  1.00  0.00           C  
HETATM   33  C   UNL     1       5.188   0.171  -1.441  1.00  0.00           C  
HETATM   34  F   UNL     1       3.506  -2.056  -1.682  1.00  0.00           F  
HETATM   35  F   UNL     1       1.249  -1.885  -1.995  1.00  0.00           F  
HETATM   36  N   UNL     1      -2.386   3.229  -0.847  1.00  0.00           N  
HETATM   37  O   UNL     1      -2.372   4.368  -2.751  1.00  0.00           O  
HETATM   38  H   UNL     1       4.145   0.721   2.205  1.00  0.00           H  
HETATM   39  H   UNL     1       0.144  -0.699  -0.305  1.00  0.00           H  
HETATM   40  H   UNL     1       2.577  -0.395  -2.419  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.536   1.031   3.672  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.336  -0.228   4.064  1.00  0.00           H  
HETATM   43  H   UNL     1       0.342   2.616   3.164  1.00  0.00           H  
HETATM   44  H   UNL     1       0.383   2.048   4.852  1.00  0.00           H  
HETATM   45  H   UNL     1       2.109   0.429   4.336  1.00  0.00           H  
HETATM   46  H   UNL     1       2.630   1.997   3.680  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.003  -1.019  -0.949  1.00  0.00           H  
HETATM   48  H   UNL     1       8.805  -0.814   0.213  1.00  0.00           H  
HETATM   49  H   UNL     1       8.068  -2.431   0.305  1.00  0.00           H  
HETATM   50  H   UNL     1       8.596  -1.783  -1.266  1.00  0.00           H  
HETATM   51  H   UNL     1       5.792  -1.524   1.308  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.429  -2.490   1.665  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.629  -1.195   1.428  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.849  -2.595  -0.194  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.674  -3.462   1.351  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.288  -4.595  -1.818  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.444  -3.263  -2.061  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.154  -2.370  -1.859  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.957  -3.189  -0.290  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.851   3.212   1.194  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.568   2.678   0.073  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.251   3.521  -1.775  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.316   3.281  -0.012  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.803   1.199  -2.174  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.102   1.222  -0.954  1.00  0.00           H  
HETATM   66  H   UNL     1       0.077   3.866  -0.702  1.00  0.00           H  
HETATM   67  H   UNL     1       0.256   3.980  -2.470  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.206   5.417  -1.528  1.00  0.00           H  
HETATM   69  H   UNL     1       4.596   0.757  -2.129  1.00  0.00           H  
CONECT    1    2   25    8    8                                       
CONECT    2    3    3    1   38                                       
CONECT    3   13    2    2    5                                       
CONECT    4   17   33   33                                            
CONECT    5    3    7    6    6                                       
CONECT    6    5    5    8   39                                       
CONECT    7   10    5   14                                            
CONECT    8    1    1    6    9                                       
CONECT    9    8   35   34   40                                       
CONECT   10   11    7   41   42                                       
CONECT   11   13   10   43   44                                       
CONECT   12   14   14   16                                            
CONECT   13    3   11   45   46                                       
CONECT   14    7   27   12   12                                       
CONECT   15   16   21   24   47                                       
CONECT   16   12   26   15                                            
CONECT   17   18    4   20                                            
CONECT   18   17   48   49   50                                       
CONECT   19   22   23                                                 
CONECT   20   17   25   25   51                                       
CONECT   21   15   22   52   53                                       
CONECT   22   21   19   54   55                                       
CONECT   23   24   19   56   57                                       
CONECT   24   15   23   58   59                                       
CONECT   25   33   20   20    1                                       
CONECT   26   27   27   16   30                                       
CONECT   27   28   14   26   26                                       
CONECT   28   27   36   60   61                                       
CONECT   29   36   30   62   63                                       
CONECT   30   26   29   64   65                                       
CONECT   31   32   36   37   37                                       
CONECT   32   31   66   67   68                                       
CONECT   33    4    4   25   69                                       
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   28   31   29                                            
CONECT   37   31   31                                                 
CONECT   38    2                                                      
CONECT   39    6                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   30                                                      
CONECT   66   32                                                      
CONECT   67   32                                                      
CONECT   68   32                                                      
CONECT   69   33                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
