COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       5.641   1.275   0.045  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.845  -0.895   1.041  1.00  0.00           C  
HETATM    3  C   UNL     1       5.318   0.029  -0.452  1.00  0.00           C  
HETATM    4  C   UNL     1       4.064  -0.202  -0.989  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.616  -1.506   1.328  1.00  0.00           C  
HETATM    6  C   UNL     1       5.034   3.638   0.543  1.00  0.00           C  
HETATM    7  C   UNL     1       1.804  -2.282   0.203  1.00  0.00           C  
HETATM    8  C   UNL     1       0.736  -1.918  -0.610  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.466  -1.533  -0.050  1.00  0.00           C  
HETATM   10  C   UNL     1       0.456  -1.871   2.154  1.00  0.00           C  
HETATM   11  C   UNL     1       1.669  -2.260   1.581  1.00  0.00           C  
HETATM   12  N   UNL     1       3.019  -2.672  -0.373  1.00  0.00           N  
HETATM   13  N   UNL     1       0.191  -1.825   4.708  1.00  0.00           N  
HETATM   14  C   UNL     1       4.697   2.303   0.007  1.00  0.00           C  
HETATM   15  C   UNL     1       3.125   0.813  -1.031  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.425  -1.950   0.352  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.493  -1.719  -0.492  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.985  -0.435  -0.651  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.408   0.619   0.034  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.339   0.392   0.880  1.00  0.00           C  
HETATM   21  C   UNL     1       3.435   2.065  -0.541  1.00  0.00           C  
HETATM   22  C   UNL     1       0.308  -1.845   3.578  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.945   2.016  -0.141  1.00  0.00           C  
HETATM   24  F   UNL     1      -4.841   2.390  -1.485  1.00  0.00           F  
HETATM   25  F   UNL     1      -6.288   2.052   0.251  1.00  0.00           F  
HETATM   26  F   UNL     1      -4.205   2.903   0.648  1.00  0.00           F  
HETATM   27  O   UNL     1       6.132   3.843   1.018  1.00  0.00           O  
HETATM   28  O   UNL     1       4.121   4.629   0.504  1.00  0.00           O  
HETATM   29  O   UNL     1       2.610  -1.601  -2.559  1.00  0.00           O  
HETATM   30  O   UNL     1       4.894  -2.418  -1.957  1.00  0.00           O  
HETATM   31  O   UNL     1      -1.797  -1.121   1.876  1.00  0.00           O  
HETATM   32  S   UNL     1       3.661  -1.796  -1.623  1.00  0.00           S  
HETATM   33 CL   UNL     1      -6.328  -0.147  -1.714  1.00  0.00          Cl  
HETATM   34  H   UNL     1       6.618   1.452   0.468  1.00  0.00           H  
HETATM   35  H   UNL     1       6.047  -0.768  -0.424  1.00  0.00           H  
HETATM   36  H   UNL     1       0.847  -1.937  -1.684  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.291  -1.252  -0.687  1.00  0.00           H  
HETATM   38  H   UNL     1       2.499  -2.543   2.211  1.00  0.00           H  
HETATM   39  H   UNL     1       3.484  -3.455  -0.041  1.00  0.00           H  
HETATM   40  H   UNL     1       2.148   0.627  -1.452  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.041  -2.952   0.476  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.945  -2.540  -1.029  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.892   1.214   1.419  1.00  0.00           H  
HETATM   44  H   UNL     1       2.701   2.856  -0.573  1.00  0.00           H  
HETATM   45  H   UNL     1       4.387   5.485   0.867  1.00  0.00           H  
CONECT    1    3   14   14   34                                       
CONECT    2   16   16   20   31                                       
CONECT    3    4    4    1   35                                       
CONECT    4   32    3    3   15                                       
CONECT    5   10   31    9    9                                       
CONECT    6   14   27   27   28                                       
CONECT    7   11   12    8    8                                       
CONECT    8    7    7    9   36                                       
CONECT    9    5    5    8   37                                       
CONECT   10   22   11   11    5                                       
CONECT   11   10   10    7   38                                       
CONECT   12   32    7   39                                            
CONECT   13   22   22   22                                            
CONECT   14    1    1   21    6                                       
CONECT   15    4   21   21   40                                       
CONECT   16   17    2    2   41                                       
CONECT   17   18   18   16   42                                       
CONECT   18   33   17   17   19                                       
CONECT   19   18   23   20   20                                       
CONECT   20   19   19    2   43                                       
CONECT   21   15   15   14   44                                       
CONECT   22   13   13   13   10                                       
CONECT   23   24   19   26   25                                       
CONECT   24   23                                                      
CONECT   25   23                                                      
CONECT   26   23                                                      
CONECT   27    6    6                                                 
CONECT   28    6   45                                                 
CONECT   29   32   32                                                 
CONECT   30   32   32                                                 
CONECT   31    2    5                                                 
CONECT   32   30   30   29   29                                       
CONECT   32   12    4                                                 
CONECT   33   18                                                      
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   28                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
