COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.365  -0.579  -0.446  1.00  0.00           C  
HETATM    2  C   UNL     1       8.026  -0.611   0.245  1.00  0.00           C  
HETATM    3  C   UNL     1       7.049   0.301  -0.102  1.00  0.00           C  
HETATM    4  C   UNL     1       5.815   0.270   0.536  1.00  0.00           C  
HETATM    5  C   UNL     1       5.569  -0.677   1.521  1.00  0.00           C  
HETATM    6  C   UNL     1       3.526   0.824   0.197  1.00  0.00           C  
HETATM    7  C   UNL     1       1.238   1.301  -0.217  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.240   1.011  -0.345  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.036  -0.638  -0.079  1.00  0.00           C  
HETATM   10  N   UNL     1      -5.803  -0.009   0.798  1.00  0.00           N  
HETATM   11  C   UNL     1      -7.132  -0.068   0.725  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.910   0.616   1.677  1.00  0.00           C  
HETATM   13  C   UNL     1     -11.373  -0.265   0.484  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.006  -1.444  -1.178  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.610  -1.377  -1.095  1.00  0.00           C  
HETATM   16  F   UNL     1       9.204  -0.102  -1.752  1.00  0.00           F  
HETATM   17  F   UNL     1      10.232   0.266   0.255  1.00  0.00           F  
HETATM   18  F   UNL     1       9.901  -1.870  -0.484  1.00  0.00           F  
HETATM   19  C   UNL     1       6.551  -1.586   1.863  1.00  0.00           C  
HETATM   20  C   UNL     1       7.776  -1.556   1.223  1.00  0.00           C  
HETATM   21  N   UNL     1       4.822   1.192   0.187  1.00  0.00           N  
HETATM   22  O   UNL     1       3.212  -0.283   0.590  1.00  0.00           O  
HETATM   23  N   UNL     1       2.578   1.682  -0.228  1.00  0.00           N  
HETATM   24  N   UNL     1       0.788   0.153   0.179  1.00  0.00           N  
HETATM   25  N   UNL     1      -0.578  -0.009   0.108  1.00  0.00           N  
HETATM   26  S   UNL     1      -2.990   1.087  -0.542  1.00  0.00           S  
HETATM   27  C   UNL     1      -3.536  -0.545   0.030  1.00  0.00           C  
HETATM   28  C   UNL     1      -9.269   0.554   1.600  1.00  0.00           C  
HETATM   29  C   UNL     1      -9.871  -0.190   0.576  1.00  0.00           C  
HETATM   30  C   UNL     1      -9.107  -0.841  -0.330  1.00  0.00           C  
HETATM   31  N   UNL     1      -7.748  -0.785  -0.263  1.00  0.00           N  
HETATM   32  O   UNL     1      -7.544  -2.087  -2.066  1.00  0.00           O  
HETATM   33  S   UNL     1      -0.112   2.306  -0.732  1.00  0.00           S  
HETATM   34  H   UNL     1       7.243   1.036  -0.868  1.00  0.00           H  
HETATM   35  H   UNL     1       4.611  -0.703   2.019  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.434   1.185   2.461  1.00  0.00           H  
HETATM   37  H   UNL     1     -11.816   0.317   1.293  1.00  0.00           H  
HETATM   38  H   UNL     1     -11.699   0.139  -0.474  1.00  0.00           H  
HETATM   39  H   UNL     1     -11.691  -1.304   0.568  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.992  -1.893  -1.815  1.00  0.00           H  
HETATM   41  H   UNL     1       6.359  -2.326   2.626  1.00  0.00           H  
HETATM   42  H   UNL     1       8.543  -2.268   1.493  1.00  0.00           H  
HETATM   43  H   UNL     1       5.067   2.097  -0.063  1.00  0.00           H  
HETATM   44  H   UNL     1       2.828   2.565  -0.541  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.237  -0.685   1.068  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.079  -1.318  -0.588  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.878   1.074   2.325  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.580  -1.412  -1.115  1.00  0.00           H  
CONECT    1   16    2   17   18                                       
CONECT    2   20    1    3    3                                       
CONECT    3    2    2    4   34                                       
CONECT    4    5    5    3   21                                       
CONECT    5   19    4    4   35                                       
CONECT    6   21   23   22   22                                       
CONECT    7   23   24   24   33                                       
CONECT    8   33   25   25   26                                       
CONECT    9   27   10   15   15                                       
CONECT   10    9   11   11                                            
CONECT   11   10   10   12   31                                       
CONECT   12   11   28   28   36                                       
CONECT   13   29   37   38   39                                       
CONECT   14   15   31   32   32                                       
CONECT   15    9    9   14   40                                       
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19   20   20    5   41                                       
CONECT   20   19   19    2   42                                       
CONECT   21    4    6   43                                            
CONECT   22    6    6                                                 
CONECT   23    6    7   44                                            
CONECT   24    7    7   25                                            
CONECT   25   24    8    8                                            
CONECT   26    8   27                                                 
CONECT   27   26    9   45   46                                       
CONECT   28   12   12   29   47                                       
CONECT   29   28   30   30   13                                       
CONECT   30   31   29   29   48                                       
CONECT   31   11   14   30                                            
CONECT   32   14   14                                                 
CONECT   33    7    8                                                 
CONECT   34    3                                                      
CONECT   35    5                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   23                                                      
CONECT   45   27                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   30                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
