COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.626  -2.436   0.546  1.00  0.00           C  
HETATM    2  C   UNL     1       6.256  -0.451   1.107  1.00  0.00           C  
HETATM    3  C   UNL     1       4.713  -0.564   1.181  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.321   0.064   2.097  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.418  -0.697   1.840  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.958  -0.374   0.544  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.019  -2.604   0.024  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.687  -1.935  -1.183  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.678   0.186  -0.688  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.005   1.640  -0.462  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.099   1.991   0.306  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.416  -1.628   0.794  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.399   3.324   0.512  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.605   4.307  -0.049  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.510   3.955  -0.816  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.207   2.622  -1.018  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.292  -1.811  -0.023  1.00  0.00           C  
HETATM   18  C   UNL     1       0.841  -1.083   0.178  1.00  0.00           C  
HETATM   19  C   UNL     1       0.872  -0.095   1.260  1.00  0.00           C  
HETATM   20  C   UNL     1       5.258   0.764  -0.733  1.00  0.00           C  
HETATM   21  C   UNL     1       6.474  -0.123  -0.393  1.00  0.00           C  
HETATM   22  C   UNL     1       8.882  -0.181  -0.153  1.00  0.00           C  
HETATM   23  C   UNL     1       7.878   1.041  -1.986  1.00  0.00           C  
HETATM   24  F   UNL     1       1.926   0.916  -1.036  1.00  0.00           F  
HETATM   25  N   UNL     1       1.955   0.629   1.483  1.00  0.00           N  
HETATM   26  N   UNL     1       4.214   0.474   0.261  1.00  0.00           N  
HETATM   27  N   UNL     1       7.728   0.617  -0.587  1.00  0.00           N  
HETATM   28  N   UNL     1      -3.819  -1.830   0.379  1.00  0.00           N  
HETATM   29  O   UNL     1      -2.547  -3.648   0.487  1.00  0.00           O  
HETATM   30  O   UNL     1       2.884   2.595   0.514  1.00  0.00           O  
HETATM   31  O   UNL     1      -5.886  -0.548  -0.901  1.00  0.00           O  
HETATM   32  S   UNL     1       2.725   1.194   0.334  1.00  0.00           S  
HETATM   33 CL   UNL     1      -0.343  -2.984  -1.301  1.00  0.00          Cl  
HETATM   34  H   UNL     1       6.619   0.359   1.741  1.00  0.00           H  
HETATM   35  H   UNL     1       6.731  -1.395   1.374  1.00  0.00           H  
HETATM   36  H   UNL     1       4.389  -1.551   0.850  1.00  0.00           H  
HETATM   37  H   UNL     1       4.366  -0.371   2.195  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.330   0.780   2.905  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.302  -0.583   2.450  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.972   0.082   0.633  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.543  -0.161   1.440  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.710  -2.615   0.867  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.735  -3.625  -0.232  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.046  -2.040  -2.058  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.648  -2.410  -1.376  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.034   0.088  -1.561  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.720   1.223   0.744  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.255   3.599   1.112  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.840   5.348   0.112  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.889   4.723  -1.254  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.349   2.348  -1.615  1.00  0.00           H  
HETATM   52  H   UNL     1       1.704  -1.228  -0.454  1.00  0.00           H  
HETATM   53  H   UNL     1       5.540   1.816  -0.679  1.00  0.00           H  
HETATM   54  H   UNL     1       4.896   0.530  -1.734  1.00  0.00           H  
HETATM   55  H   UNL     1       6.465  -1.034  -0.992  1.00  0.00           H  
HETATM   56  H   UNL     1       8.927  -1.102  -0.734  1.00  0.00           H  
HETATM   57  H   UNL     1       9.798   0.390  -0.308  1.00  0.00           H  
HETATM   58  H   UNL     1       8.779  -0.423   0.905  1.00  0.00           H  
HETATM   59  H   UNL     1       7.044   1.688  -2.260  1.00  0.00           H  
HETATM   60  H   UNL     1       8.814   1.587  -2.101  1.00  0.00           H  
HETATM   61  H   UNL     1       7.885   0.164  -2.633  1.00  0.00           H  
CONECT    1   29   29   28   12                                       
CONECT    2    3   21   34   35                                       
CONECT    3   26    2   36   37                                       
CONECT    4   19   19    5   38                                       
CONECT    5   12   12    4   39                                       
CONECT    6    9   28   40   41                                       
CONECT    7    8   28   42   43                                       
CONECT    8   31    7   44   45                                       
CONECT    9   10   31    6   46                                       
CONECT   10   11    9   16   16                                       
CONECT   11   13   13   10   47                                       
CONECT   12   17    1    5    5                                       
CONECT   13   11   11   14   48                                       
CONECT   14   13   15   15   49                                       
CONECT   15   14   14   16   50                                       
CONECT   16   10   10   15   51                                       
CONECT   17   33   18   18   12                                       
CONECT   18   17   17   19   52                                       
CONECT   19   18   25    4    4                                       
CONECT   20   26   21   53   54                                       
CONECT   21    2   20   27   55                                       
CONECT   22   27   56   57   58                                       
CONECT   23   27   59   60   61                                       
CONECT   24   32                                                      
CONECT   25   32   32   19                                            
CONECT   26   32    3   20                                            
CONECT   27   21   22   23                                            
CONECT   28    1    6    7                                            
CONECT   29    1    1                                                 
CONECT   30   32   32                                                 
CONECT   31    9    8                                                 
CONECT   32   30   30   24   25                                       
CONECT   32   25   26                                                 
CONECT   33   17                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   11                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   18                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   23                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
