COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.866   0.861  -0.442  1.00  0.00           C  
HETATM    2  C   UNL     1       0.358  -1.911   0.443  1.00  0.00           C  
HETATM    3  C   UNL     1       0.181   0.616   0.513  1.00  0.00           C  
HETATM    4  C   UNL     1       2.519   1.033  -0.239  1.00  0.00           C  
HETATM    5  C   UNL     1       3.863   1.230   0.045  1.00  0.00           C  
HETATM    6  C   UNL     1       4.304   1.221   1.362  1.00  0.00           C  
HETATM    7  C   UNL     1       2.068   0.819   2.128  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.135  -1.147  -0.068  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.074  -2.541  -0.112  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.931  -3.180   0.002  1.00  0.00           N  
HETATM   11  C   UNL     1      -2.956  -0.422   0.100  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.481  -2.966   0.304  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.353  -0.747   0.400  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.765  -1.131   0.217  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.782  -2.536   0.163  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.437  -0.446  -0.199  1.00  0.00           C  
HETATM   17  C   UNL     1       1.612   0.826   0.805  1.00  0.00           C  
HETATM   18  C   UNL     1       3.409   1.017   2.396  1.00  0.00           C  
HETATM   19  F   UNL     1       1.198   0.620   3.142  1.00  0.00           F  
HETATM   20  F   UNL     1       2.088   1.046  -1.520  1.00  0.00           F  
HETATM   21  N   UNL     1       4.776   1.437  -0.997  1.00  0.00           N  
HETATM   22  S   UNL     1       6.312   0.830  -0.885  1.00  0.00           S  
HETATM   23  O   UNL     1       6.906   1.146  -2.136  1.00  0.00           O  
HETATM   24  O   UNL     1       6.818   1.377   0.325  1.00  0.00           O  
HETATM   25  C   UNL     1       6.081  -0.962  -0.725  1.00  0.00           C  
HETATM   26  C   UNL     1       7.445  -1.645  -0.612  1.00  0.00           C  
HETATM   27  C   UNL     1       7.249  -3.157  -0.477  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.611  -1.178  -0.367  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.819  -0.522  -0.488  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.702   1.592  -0.275  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.490   0.945  -0.153  1.00  0.00           C  
HETATM   32 CL   UNL     1      -9.388   1.681  -0.602  1.00  0.00          Cl  
HETATM   33  H   UNL     1       1.428  -1.981   0.573  1.00  0.00           H  
HETATM   34  H   UNL     1       5.351   1.374   1.579  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.985  -3.106  -0.242  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.966   0.658   0.138  1.00  0.00           H  
HETATM   37  H   UNL     1       3.760   1.011   3.418  1.00  0.00           H  
HETATM   38  H   UNL     1       4.508   1.936  -1.784  1.00  0.00           H  
HETATM   39  H   UNL     1       5.493  -1.174   0.169  1.00  0.00           H  
HETATM   40  H   UNL     1       5.556  -1.341  -1.602  1.00  0.00           H  
HETATM   41  H   UNL     1       8.032  -1.433  -1.505  1.00  0.00           H  
HETATM   42  H   UNL     1       7.969  -1.267   0.266  1.00  0.00           H  
HETATM   43  H   UNL     1       6.662  -3.369   0.417  1.00  0.00           H  
HETATM   44  H   UNL     1       6.725  -3.535  -1.354  1.00  0.00           H  
HETATM   45  H   UNL     1       8.222  -3.643  -0.396  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.575  -2.257  -0.403  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.729  -1.088  -0.619  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.744   2.671  -0.239  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.582   1.517  -0.023  1.00  0.00           H  
HETATM   50  O   UNL     1      -0.557   1.573   0.366  1.00  0.00           O  
HETATM   51  H   UNL     1      -0.204  -3.896   0.303  1.00  0.00           H  
CONECT    1   29   29   30   32                                       
CONECT    2   12   13   13   33                                       
CONECT    3   13   17   50   50                                       
CONECT    4    5    5   17   20                                       
CONECT    5    4    4    6   21                                       
CONECT    6    5   18   18   34                                       
CONECT    7   17   17   18   19                                       
CONECT    8    9    9   11   16                                       
CONECT    9    8    8   10   35                                       
CONECT   10    9   15   15                                            
CONECT   11    8   14   14   36                                       
CONECT   12    2   15   51                                            
CONECT   13    2    2    3   14                                       
CONECT   14   11   11   13   15                                       
CONECT   15   10   10   12   14                                       
CONECT   16    8   28   28   31                                       
CONECT   17    3    4    7    7                                       
CONECT   18    6    6    7   37                                       
CONECT   19    7                                                      
CONECT   20    4                                                      
CONECT   21    5   22   38                                            
CONECT   22   21   23   23   24                                       
CONECT   22   24   25                                                 
CONECT   23   22   22                                                 
CONECT   24   22   22                                                 
CONECT   25   22   26   39   40                                       
CONECT   26   25   27   41   42                                       
CONECT   27   26   43   44   45                                       
CONECT   28   16   16   29   46                                       
CONECT   29    1    1   28   47                                       
CONECT   30    1   31   31   48                                       
CONECT   31   16   30   30   49                                       
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    6                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   18                                                      
CONECT   38   21                                                      
CONECT   39   25                                                      
CONECT   40   25                                                      
CONECT   41   26                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
CONECT   44   27                                                      
CONECT   45   27                                                      
CONECT   46   28                                                      
CONECT   47   29                                                      
CONECT   48   30                                                      
CONECT   49   31                                                      
CONECT   50    3    3                                                 
CONECT   51   12                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
