COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       1.556  -3.023   0.158  1.00  0.00           F  
HETATM    2  C   UNL     1       2.623  -2.618  -0.566  1.00  0.00           C  
HETATM    3  C   UNL     1       2.668  -2.860  -1.928  1.00  0.00           C  
HETATM    4  C   UNL     1       3.762  -2.445  -2.668  1.00  0.00           C  
HETATM    5  F   UNL     1       3.807  -2.681  -3.997  1.00  0.00           F  
HETATM    6  C   UNL     1       4.810  -1.788  -2.045  1.00  0.00           C  
HETATM    7  C   UNL     1       4.764  -1.547  -0.685  1.00  0.00           C  
HETATM    8  C   UNL     1       3.670  -1.956   0.054  1.00  0.00           C  
HETATM    9  S   UNL     1       3.613  -1.647   1.788  1.00  0.00           S  
HETATM   10  O   UNL     1       3.237  -2.872   2.401  1.00  0.00           O  
HETATM   11  O   UNL     1       4.809  -0.951   2.111  1.00  0.00           O  
HETATM   12  N   UNL     1       2.368  -0.589   2.057  1.00  0.00           N  
HETATM   13  C   UNL     1       2.397   0.684   1.482  1.00  0.00           C  
HETATM   14  C   UNL     1       1.268   1.191   0.855  1.00  0.00           C  
HETATM   15  C   UNL     1       1.300   2.457   0.285  1.00  0.00           C  
HETATM   16  C   UNL     1       3.556   1.450   1.541  1.00  0.00           C  
HETATM   17  C   UNL     1       3.582   2.708   0.975  1.00  0.00           C  
HETATM   18  C   UNL     1       2.458   3.218   0.345  1.00  0.00           C  
HETATM   19  C   UNL     1       2.524   4.599  -0.253  1.00  0.00           C  
HETATM   20  C   UNL     1       1.424   4.782  -1.298  1.00  0.00           C  
HETATM   21  C   UNL     1       0.079   4.376  -0.680  1.00  0.00           C  
HETATM   22  N   UNL     1       0.152   2.947  -0.347  1.00  0.00           N  
HETATM   23  S   UNL     1      -1.105   1.933  -0.712  1.00  0.00           S  
HETATM   24  O   UNL     1      -1.852   2.640  -1.693  1.00  0.00           O  
HETATM   25  O   UNL     1      -0.479   0.696  -1.020  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.046   1.804   0.834  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.231   0.896   0.626  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.437   1.419   0.199  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.523   0.586   0.009  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.404  -0.771   0.245  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.588  -1.679   0.037  1.00  0.00           C  
HETATM   32  F   UNL     1      -6.503  -2.764   0.915  1.00  0.00           F  
HETATM   33  F   UNL     1      -7.768  -0.970   0.284  1.00  0.00           F  
HETATM   34  F   UNL     1      -6.592  -2.145  -1.282  1.00  0.00           F  
HETATM   35  C   UNL     1      -4.197  -1.294   0.670  1.00  0.00           C  
HETATM   36  C   UNL     1      -3.110  -0.462   0.857  1.00  0.00           C  
HETATM   37  H   UNL     1       1.850  -3.373  -2.412  1.00  0.00           H  
HETATM   38  H   UNL     1       5.663  -1.465  -2.622  1.00  0.00           H  
HETATM   39  H   UNL     1       5.581  -1.035  -0.200  1.00  0.00           H  
HETATM   40  H   UNL     1       1.619  -0.852   2.614  1.00  0.00           H  
HETATM   41  H   UNL     1       0.365   0.600   0.809  1.00  0.00           H  
HETATM   42  H   UNL     1       4.436   1.060   2.031  1.00  0.00           H  
HETATM   43  H   UNL     1       4.485   3.299   1.023  1.00  0.00           H  
HETATM   44  H   UNL     1       2.396   5.339   0.537  1.00  0.00           H  
HETATM   45  H   UNL     1       3.496   4.741  -0.725  1.00  0.00           H  
HETATM   46  H   UNL     1       1.383   5.827  -1.607  1.00  0.00           H  
HETATM   47  H   UNL     1       1.634   4.154  -2.164  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.102   4.958   0.224  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.723   4.549  -1.397  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.407   1.394   1.615  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.395   2.793   1.131  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.530   2.480   0.015  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.466   0.996  -0.323  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.104  -2.355   0.854  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.166  -0.872   1.185  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    3    3    8    1                                       
CONECT    3    4    2    2   37                                       
CONECT    4    5    6    6    3                                       
CONECT    5    4                                                      
CONECT    6    4    4    7   38                                       
CONECT    7    6    8    8   39                                       
CONECT    8    7    7    2    9                                       
CONECT    9    8   10   10   11                                       
CONECT    9   11   12                                                 
CONECT   10    9    9                                                 
CONECT   11    9    9                                                 
CONECT   12    9   13   40                                            
CONECT   13   12   14   14   16                                       
CONECT   14   13   13   15   41                                       
CONECT   15   14   22   18   18                                       
CONECT   16   13   17   17   42                                       
CONECT   17   16   16   18   43                                       
CONECT   18   15   15   17   19                                       
CONECT   19   18   20   44   45                                       
CONECT   20   21   19   46   47                                       
CONECT   21   22   20   48   49                                       
CONECT   22   23   15   21                                            
CONECT   23   26   24   24   25                                       
CONECT   23   25   22                                                 
CONECT   24   23   23                                                 
CONECT   25   23   23                                                 
CONECT   26   27   23   50   51                                       
CONECT   27   26   28   28   36                                       
CONECT   28   27   27   29   52                                       
CONECT   29   28   30   30   53                                       
CONECT   30   29   29   35   31                                       
CONECT   31   33   32   30   34                                       
CONECT   32   31                                                      
CONECT   33   31                                                      
CONECT   34   31                                                      
CONECT   35   36   36   30   54                                       
CONECT   36   27   35   35   55                                       
CONECT   37    3                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40   12                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   35                                                      
CONECT   55   36                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
