COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -7.057  -2.303  -0.012  1.00  0.00           F  
HETATM    2  C   UNL     1      -5.720  -2.003   0.268  1.00  0.00           C  
HETATM    3  F   UNL     1      -5.479  -2.175   1.635  1.00  0.00           F  
HETATM    4  F   UNL     1      -4.888  -2.859  -0.464  1.00  0.00           F  
HETATM    5  C   UNL     1      -5.429  -0.553  -0.123  1.00  0.00           C  
HETATM    6  O   UNL     1      -5.675  -0.377  -1.520  1.00  0.00           O  
HETATM    7  C   UNL     1      -6.339   0.382   0.677  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.988  -0.230   0.178  1.00  0.00           C  
HETATM    9  O   UNL     1      -3.393  -0.853   1.031  1.00  0.00           O  
HETATM   10  N   UNL     1      -3.361   0.750  -0.502  1.00  0.00           N  
HETATM   11  C   UNL     1      -2.061   1.128  -0.145  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.598   0.894   1.143  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.315   1.269   1.492  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.230   1.734  -1.080  1.00  0.00           C  
HETATM   15 CL   UNL     1      -1.803   2.024  -2.693  1.00  0.00          Cl  
HETATM   16  C   UNL     1       0.052   2.106  -0.724  1.00  0.00           C  
HETATM   17  C   UNL     1       0.508   1.877   0.562  1.00  0.00           C  
HETATM   18  S   UNL     1       2.143   2.353   1.013  1.00  0.00           S  
HETATM   19  O   UNL     1       2.520   3.390   0.116  1.00  0.00           O  
HETATM   20  O   UNL     1       2.141   2.510   2.425  1.00  0.00           O  
HETATM   21  C   UNL     1       3.199   0.986   0.666  1.00  0.00           C  
HETATM   22  C   UNL     1       3.425   0.027   1.636  1.00  0.00           C  
HETATM   23  C   UNL     1       4.251  -1.046   1.371  1.00  0.00           C  
HETATM   24  C   UNL     1       3.794   0.874  -0.578  1.00  0.00           C  
HETATM   25  C   UNL     1       4.622  -0.194  -0.857  1.00  0.00           C  
HETATM   26  C   UNL     1       4.859  -1.162   0.120  1.00  0.00           C  
HETATM   27  C   UNL     1       5.746  -2.309  -0.171  1.00  0.00           C  
HETATM   28  O   UNL     1       5.399  -3.436   0.127  1.00  0.00           O  
HETATM   29  N   UNL     1       6.938  -2.105  -0.766  1.00  0.00           N  
HETATM   30  C   UNL     1       7.857  -3.228  -0.968  1.00  0.00           C  
HETATM   31  C   UNL     1       7.314  -0.761  -1.210  1.00  0.00           C  
HETATM   32  H   UNL     1      -5.132  -0.940  -2.089  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.151   0.248   1.742  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.132   1.416   0.398  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.381   0.149   0.459  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.810   1.193  -1.238  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.239   0.420   1.870  1.00  0.00           H  
HETATM   38  H   UNL     1       0.046   1.087   2.494  1.00  0.00           H  
HETATM   39  H   UNL     1       0.698   2.577  -1.449  1.00  0.00           H  
HETATM   40  H   UNL     1       2.954   0.118   2.604  1.00  0.00           H  
HETATM   41  H   UNL     1       4.427  -1.794   2.130  1.00  0.00           H  
HETATM   42  H   UNL     1       3.610   1.624  -1.333  1.00  0.00           H  
HETATM   43  H   UNL     1       5.086  -0.280  -1.828  1.00  0.00           H  
HETATM   44  H   UNL     1       7.658  -3.690  -1.935  1.00  0.00           H  
HETATM   45  H   UNL     1       8.884  -2.866  -0.942  1.00  0.00           H  
HETATM   46  H   UNL     1       7.711  -3.964  -0.177  1.00  0.00           H  
HETATM   47  H   UNL     1       6.545  -0.050  -0.909  1.00  0.00           H  
HETATM   48  H   UNL     1       8.265  -0.481  -0.755  1.00  0.00           H  
HETATM   49  H   UNL     1       7.414  -0.752  -2.295  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    4    5                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    2    7    6    8                                       
CONECT    6    5   32                                                 
CONECT    7    5   33   34   35                                       
CONECT    8    5    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   36                                            
CONECT   11   10   12   12   14                                       
CONECT   12   11   11   13   37                                       
CONECT   13   12   17   17   38                                       
CONECT   14   11   15   16   16                                       
CONECT   15   14                                                      
CONECT   16   14   14   17   39                                       
CONECT   17   13   13   16   18                                       
CONECT   18   17   19   19   20                                       
CONECT   18   20   21                                                 
CONECT   19   18   18                                                 
CONECT   20   18   18                                                 
CONECT   21   18   24   24   22                                       
CONECT   22   21   23   23   40                                       
CONECT   23   22   22   26   41                                       
CONECT   24   21   21   25   42                                       
CONECT   25   24   26   26   43                                       
CONECT   26   23   25   25   27                                       
CONECT   27   26   29   28   28                                       
CONECT   28   27   27                                                 
CONECT   29   27   30   31                                            
CONECT   30   29   44   45   46                                       
CONECT   31   29   47   48   49                                       
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   16                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
CONECT   44   30                                                      
CONECT   45   30                                                      
CONECT   46   30                                                      
CONECT   47   31                                                      
CONECT   48   31                                                      
CONECT   49   31                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
