COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1       8.474   1.113  -0.046  1.00  0.00          Cl  
HETATM    2  C   UNL     1       7.844  -0.504  -0.013  1.00  0.00           C  
HETATM    3  C   UNL     1       8.707  -1.584  -0.001  1.00  0.00           C  
HETATM    4  C   UNL     1       8.205  -2.872   0.026  1.00  0.00           C  
HETATM    5  C   UNL     1       6.838  -3.086   0.040  1.00  0.00           C  
HETATM    6  C   UNL     1       5.970  -2.012   0.028  1.00  0.00           C  
HETATM    7  C   UNL     1       6.469  -0.716   0.007  1.00  0.00           C  
HETATM    8  S   UNL     1       5.365   0.657  -0.009  1.00  0.00           S  
HETATM    9  C   UNL     1       3.732  -0.134   0.008  1.00  0.00           C  
HETATM   10  C   UNL     1       2.644   0.942  -0.004  1.00  0.00           C  
HETATM   11  N   UNL     1       1.326   0.304   0.010  1.00  0.00           N  
HETATM   12  C   UNL     1       0.210   1.061   0.003  1.00  0.00           C  
HETATM   13  O   UNL     1       0.299   2.270  -0.015  1.00  0.00           O  
HETATM   14  C   UNL     1      -1.146   0.404   0.017  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.295  -0.485  -1.218  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.286  -0.449   1.280  1.00  0.00           C  
HETATM   17  S   UNL     1      -2.435   1.680   0.003  1.00  0.00           S  
HETATM   18  O   UNL     1      -2.441   2.397   1.230  1.00  0.00           O  
HETATM   19  O   UNL     1      -2.449   2.361  -1.244  1.00  0.00           O  
HETATM   20  C   UNL     1      -3.948   0.776   0.022  1.00  0.00           C  
HETATM   21  N   UNL     1      -4.509   0.421  -1.118  1.00  0.00           N  
HETATM   22  C   UNL     1      -5.640  -0.256  -1.152  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.283  -0.619   0.016  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.575  -1.392  -0.032  1.00  0.00           C  
HETATM   25  F   UNL     1      -8.585  -0.654   0.594  1.00  0.00           F  
HETATM   26  F   UNL     1      -7.928  -1.628  -1.365  1.00  0.00           F  
HETATM   27  F   UNL     1      -7.412  -2.614   0.630  1.00  0.00           F  
HETATM   28  C   UNL     1      -5.723  -0.262   1.234  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.530   0.444   1.230  1.00  0.00           C  
HETATM   30  H   UNL     1       9.774  -1.421  -0.013  1.00  0.00           H  
HETATM   31  H   UNL     1       8.882  -3.714   0.036  1.00  0.00           H  
HETATM   32  H   UNL     1       6.450  -4.093   0.061  1.00  0.00           H  
HETATM   33  H   UNL     1       4.903  -2.180   0.038  1.00  0.00           H  
HETATM   34  H   UNL     1       3.625  -0.767  -0.872  1.00  0.00           H  
HETATM   35  H   UNL     1       3.632  -0.741   0.907  1.00  0.00           H  
HETATM   36  H   UNL     1       2.750   1.576   0.877  1.00  0.00           H  
HETATM   37  H   UNL     1       2.744   1.550  -0.903  1.00  0.00           H  
HETATM   38  H   UNL     1       1.255  -0.663   0.024  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.520  -1.252  -1.210  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.276  -0.960  -1.208  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.195   0.122  -2.118  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.180   0.185   2.160  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.267  -0.924   1.290  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.511  -1.215   1.288  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.069  -0.529  -2.105  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.203  -0.532   2.163  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.063   0.734   2.160  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    7    7    3    1                                       
CONECT    3    4    4    2   30                                       
CONECT    4    5    3    3   31                                       
CONECT    5    6    6    4   32                                       
CONECT    6    5    5    7   33                                       
CONECT    7    8    6    2    2                                       
CONECT    8    9    7                                                 
CONECT    9    8   10   34   35                                       
CONECT   10    9   11   36   37                                       
CONECT   11   12   10   38                                            
CONECT   12   13   13   14   11                                       
CONECT   13   12   12                                                 
CONECT   14   17   12   15   16                                       
CONECT   15   14   39   40   41                                       
CONECT   16   14   42   43   44                                       
CONECT   17   19   19   18   18                                       
CONECT   17   20   14                                                 
CONECT   18   17   17                                                 
CONECT   19   17   17                                                 
CONECT   20   21   17   29   29                                       
CONECT   21   22   22   20                                            
CONECT   22   21   21   23   45                                       
CONECT   23   22   24   28   28                                       
CONECT   24   25   27   23   26                                       
CONECT   25   24                                                      
CONECT   26   24                                                      
CONECT   27   24                                                      
CONECT   28   23   23   29   46                                       
CONECT   29   20   20   28   47                                       
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   22                                                      
CONECT   46   28                                                      
CONECT   47   29                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
