COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.886  -1.060   0.838  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.051  -1.031   0.090  1.00  0.00           C  
HETATM    3  F   UNL     1      -4.982  -1.997   0.251  1.00  0.00           F  
HETATM    4  C   UNL     1      -4.261  -0.010  -0.824  1.00  0.00           C  
HETATM    5  F   UNL     1      -5.397   0.020  -1.555  1.00  0.00           F  
HETATM    6  C   UNL     1      -3.306   0.978  -0.987  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.144   0.947  -0.239  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.934  -0.071   0.673  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.667  -0.103   1.487  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.327   1.224   1.891  1.00  0.00           O  
HETATM   11  C   UNL     1       0.451  -0.677   0.654  1.00  0.00           C  
HETATM   12  C   UNL     1       1.011  -1.831   0.971  1.00  0.00           C  
HETATM   13  C   UNL     1       0.522  -2.582   2.182  1.00  0.00           C  
HETATM   14  N   UNL     1       2.039  -2.363   0.210  1.00  0.00           N  
HETATM   15  C   UNL     1       2.613  -3.647   0.620  1.00  0.00           C  
HETATM   16  C   UNL     1       2.535  -1.765  -0.881  1.00  0.00           C  
HETATM   17  S   UNL     1       3.807  -2.522  -1.740  1.00  0.00           S  
HETATM   18  N   UNL     1       2.058  -0.583  -1.321  1.00  0.00           N  
HETATM   19  C   UNL     1       0.960   0.050  -0.573  1.00  0.00           C  
HETATM   20  C   UNL     1       1.426   1.417  -0.142  1.00  0.00           C  
HETATM   21  C   UNL     1       0.828   2.547  -0.665  1.00  0.00           C  
HETATM   22  C   UNL     1       2.448   1.538   0.781  1.00  0.00           C  
HETATM   23  C   UNL     1       2.878   2.791   1.179  1.00  0.00           C  
HETATM   24  C   UNL     1       2.288   3.924   0.654  1.00  0.00           C  
HETATM   25  C   UNL     1       1.258   3.805  -0.268  1.00  0.00           C  
HETATM   26  O   UNL     1       0.672   4.918  -0.782  1.00  0.00           O  
HETATM   27  H   UNL     1      -2.724  -1.852   1.553  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.468   1.774  -1.699  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.399   1.718  -0.367  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.818  -0.725   2.370  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.294   1.861   1.164  1.00  0.00           H  
HETATM   32  H   UNL     1       0.120   0.186  -1.254  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.554  -2.445   2.284  1.00  0.00           H  
HETATM   34  H   UNL     1       0.745  -3.642   2.067  1.00  0.00           H  
HETATM   35  H   UNL     1       1.023  -2.200   3.073  1.00  0.00           H  
HETATM   36  H   UNL     1       2.099  -4.457   0.101  1.00  0.00           H  
HETATM   37  H   UNL     1       3.673  -3.669   0.368  1.00  0.00           H  
HETATM   38  H   UNL     1       2.493  -3.772   1.696  1.00  0.00           H  
HETATM   39  H   UNL     1       2.427  -0.162  -2.114  1.00  0.00           H  
HETATM   40  H   UNL     1       0.027   2.451  -1.384  1.00  0.00           H  
HETATM   41  H   UNL     1       2.911   0.654   1.193  1.00  0.00           H  
HETATM   42  H   UNL     1       3.676   2.884   1.901  1.00  0.00           H  
HETATM   43  H   UNL     1       2.624   4.902   0.965  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.087   5.234  -0.273  1.00  0.00           H  
CONECT    1    2    8    8   27                                       
CONECT    2    1    3    4    4                                       
CONECT    3    2                                                      
CONECT    4    2    2    5    6                                       
CONECT    5    4                                                      
CONECT    6    4    7    7   28                                       
CONECT    7    6    6    8   29                                       
CONECT    8    1    1    7    9                                       
CONECT    9    8   10   11   30                                       
CONECT   10    9   31                                                 
CONECT   11    9   12   12   19                                       
CONECT   12   11   11   13   14                                       
CONECT   13   12   33   34   35                                       
CONECT   14   12   15   16                                            
CONECT   15   14   36   37   38                                       
CONECT   16   14   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   39                                            
CONECT   19   11   18   20   32                                       
CONECT   20   19   21   22   22                                       
CONECT   21   20   25   25   40                                       
CONECT   22   20   20   23   41                                       
CONECT   23   22   24   24   42                                       
CONECT   24   23   23   25   43                                       
CONECT   25   21   21   24   26                                       
CONECT   26   25   44                                                 
CONECT   27    1                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   19                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   13                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   18                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   26                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
