COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.878   1.749  -3.250  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.928   0.466  -2.703  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.948  -0.406  -3.081  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.908   0.006  -3.982  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.853   1.279  -4.520  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.840   2.148  -4.154  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.413   0.593   1.053  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.195   0.679   0.411  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.408  -0.463   0.257  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.861  -1.688   0.751  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.078  -1.761   1.396  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.855  -0.623   1.545  1.00  0.00           C  
HETATM   13  F   UNL     1      -6.049  -0.702   2.174  1.00  0.00           F  
HETATM   14  C   UNL     1      -1.104  -0.378  -0.429  1.00  0.00           C  
HETATM   15  C   UNL     1       2.077  -0.319  -5.346  1.00  0.00           C  
HETATM   16  C   UNL     1       2.910  -1.221  -5.996  1.00  0.00           C  
HETATM   17  C   UNL     1       3.485  -0.881  -7.204  1.00  0.00           C  
HETATM   18  C   UNL     1       3.233   0.356  -7.768  1.00  0.00           C  
HETATM   19  C   UNL     1       2.404   1.256  -7.124  1.00  0.00           C  
HETATM   20  C   UNL     1       1.821   0.920  -5.918  1.00  0.00           C  
HETATM   21  O   UNL     1       1.824   1.812   9.535  1.00  0.00           O  
HETATM   22  O   UNL     1       1.588  -0.250   8.780  1.00  0.00           O  
HETATM   23  O   UNL     1       2.329  -0.624   6.247  1.00  0.00           O  
HETATM   24  C   UNL     1       1.611   0.933   8.543  1.00  0.00           C  
HETATM   25  C   UNL     1       1.401   1.423   7.133  1.00  0.00           C  
HETATM   26  C   UNL     1       1.182   0.227   6.205  1.00  0.00           C  
HETATM   27  C   UNL     1       0.969   0.725   4.774  1.00  0.00           C  
HETATM   28  C   UNL     1       0.750  -0.470   3.845  1.00  0.00           C  
HETATM   29  C   UNL     1       0.537   0.027   2.414  1.00  0.00           C  
HETATM   30  C   UNL     1       0.318  -1.168   1.485  1.00  0.00           C  
HETATM   31  N   UNL     1       0.114  -0.691   0.115  1.00  0.00           N  
HETATM   32  C   UNL     1      -0.899   0.032  -1.732  1.00  0.00           C  
HETATM   33  C   UNL     1       0.553  -0.046  -1.954  1.00  0.00           C  
HETATM   34  C   UNL     1       1.276   0.288  -3.191  1.00  0.00           C  
HETATM   35  N   UNL     1       1.492  -0.661  -4.123  1.00  0.00           N  
HETATM   36  O   UNL     1       1.679   1.421  -3.372  1.00  0.00           O  
HETATM   37  C   UNL     1       1.097  -0.500  -0.784  1.00  0.00           C  
HETATM   38  C   UNL     1       2.564  -0.741  -0.539  1.00  0.00           C  
HETATM   39  C   UNL     1       3.079  -1.794  -1.523  1.00  0.00           C  
HETATM   40  C   UNL     1       3.336   0.564  -0.740  1.00  0.00           C  
HETATM   41  O   UNL     1       1.896  -1.322   3.887  1.00  0.00           O  
HETATM   42  H   UNL     1      -1.088   2.428  -2.965  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.992  -1.401  -2.661  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.701  -0.667  -4.271  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.604   1.596  -5.228  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.803   3.141  -4.578  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.023   1.476   1.172  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.852   1.628   0.028  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.257  -2.576   0.635  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.428  -2.707   1.782  1.00  0.00           H  
HETATM   51  H   UNL     1       3.107  -2.187  -5.556  1.00  0.00           H  
HETATM   52  H   UNL     1       4.133  -1.581  -7.710  1.00  0.00           H  
HETATM   53  H   UNL     1       3.684   0.620  -8.713  1.00  0.00           H  
HETATM   54  H   UNL     1       2.209   2.222  -7.566  1.00  0.00           H  
HETATM   55  H   UNL     1       1.174   1.624  -5.415  1.00  0.00           H  
HETATM   56  H   UNL     1       1.959   1.498  10.439  1.00  0.00           H  
HETATM   57  H   UNL     1       3.082  -0.094   5.952  1.00  0.00           H  
HETATM   58  H   UNL     1       2.280   1.980   6.808  1.00  0.00           H  
HETATM   59  H   UNL     1       0.527   2.073   7.101  1.00  0.00           H  
HETATM   60  H   UNL     1       0.303  -0.328   6.530  1.00  0.00           H  
HETATM   61  H   UNL     1       1.848   1.282   4.448  1.00  0.00           H  
HETATM   62  H   UNL     1       0.095   1.375   4.742  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.128  -1.027   4.171  1.00  0.00           H  
HETATM   64  H   UNL     1       1.416   0.584   2.088  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.337   0.677   2.382  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.560  -1.725   1.811  1.00  0.00           H  
HETATM   67  H   UNL     1       1.192  -1.818   1.518  1.00  0.00           H  
HETATM   68  H   UNL     1       1.243  -1.581  -3.945  1.00  0.00           H  
HETATM   69  H   UNL     1       2.709  -1.096   0.480  1.00  0.00           H  
HETATM   70  H   UNL     1       2.529  -2.724  -1.380  1.00  0.00           H  
HETATM   71  H   UNL     1       2.934  -1.439  -2.543  1.00  0.00           H  
HETATM   72  H   UNL     1       4.140  -1.968  -1.346  1.00  0.00           H  
HETATM   73  H   UNL     1       2.969   1.314  -0.039  1.00  0.00           H  
HETATM   74  H   UNL     1       4.397   0.389  -0.563  1.00  0.00           H  
HETATM   75  H   UNL     1       3.191   0.918  -1.760  1.00  0.00           H  
HETATM   76  H   UNL     1       2.650  -0.792   3.592  1.00  0.00           H  
CONECT    1    2    2    6   42                                       
CONECT    2    1    1    3   32                                       
CONECT    3    2    4    4   43                                       
CONECT    4    3    3    5   44                                       
CONECT    5    4    6    6   45                                       
CONECT    6    1    5    5   46                                       
CONECT    7    8    8   12   47                                       
CONECT    8    7    7    9   48                                       
CONECT    9    8   10   10   14                                       
CONECT   10    9    9   11   49                                       
CONECT   11   10   12   12   50                                       
CONECT   12    7   11   11   13                                       
CONECT   13   12                                                      
CONECT   14    9   31   32   32                                       
CONECT   15   16   16   20   35                                       
CONECT   16   15   15   17   51                                       
CONECT   17   16   18   18   52                                       
CONECT   18   17   17   19   53                                       
CONECT   19   18   20   20   54                                       
CONECT   20   15   19   19   55                                       
CONECT   21   24   56                                                 
CONECT   22   24   24                                                 
CONECT   23   26   57                                                 
CONECT   24   21   22   22   25                                       
CONECT   25   24   26   58   59                                       
CONECT   26   23   25   27   60                                       
CONECT   27   26   28   61   62                                       
CONECT   28   27   29   41   63                                       
CONECT   29   28   30   64   65                                       
CONECT   30   29   31   66   67                                       
CONECT   31   14   30   37                                            
CONECT   32    2   14   14   33                                       
CONECT   33   32   34   37   37                                       
CONECT   34   33   35   36   36                                       
CONECT   35   15   34   68                                            
CONECT   36   34   34                                                 
CONECT   37   31   33   33   38                                       
CONECT   38   37   39   40   69                                       
CONECT   39   38   70   71   72                                       
CONECT   40   38   73   74   75                                       
CONECT   41   28   76                                                 
CONECT   42    1                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49   10                                                      
CONECT   50   11                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   23                                                      
CONECT   58   25                                                      
CONECT   59   25                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   29                                                      
CONECT   66   30                                                      
CONECT   67   30                                                      
CONECT   68   35                                                      
CONECT   69   38                                                      
CONECT   70   39                                                      
CONECT   71   39                                                      
CONECT   72   39                                                      
CONECT   73   40                                                      
CONECT   74   40                                                      
CONECT   75   40                                                      
CONECT   76   41                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
