COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.133  -1.086   1.408  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.636  -0.883   1.117  1.00  0.00           C  
HETATM    3  N   UNL     1      -2.738  -0.102  -0.125  1.00  0.00           N  
HETATM    4  C   UNL     1      -1.374   0.163  -0.630  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.473   0.062   0.611  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.013  -0.948  -1.619  1.00  0.00           C  
HETATM    7  C   UNL     1       0.403  -0.720  -2.139  1.00  0.00           C  
HETATM    8  C   UNL     1       1.364  -0.639  -0.981  1.00  0.00           C  
HETATM    9  C   UNL     1       0.947  -0.278   0.281  1.00  0.00           C  
HETATM   10  C   UNL     1       2.697  -0.940  -1.215  1.00  0.00           C  
HETATM   11  C   UNL     1       3.619  -0.882  -0.190  1.00  0.00           C  
HETATM   12  C   UNL     1       3.206  -0.520   1.079  1.00  0.00           C  
HETATM   13  C   UNL     1       1.881  -0.220   1.311  1.00  0.00           C  
HETATM   14  C   UNL     1       5.066  -1.212  -0.452  1.00  0.00           C  
HETATM   15  S   UNL     1      -0.534   1.600   1.571  1.00  0.00           S  
HETATM   16  C   UNL     1       0.327   2.773   0.579  1.00  0.00           C  
HETATM   17  C   UNL     1       1.702   2.882   0.675  1.00  0.00           C  
HETATM   18  C   UNL     1       2.379   3.803  -0.103  1.00  0.00           C  
HETATM   19  C   UNL     1       0.303   4.500  -1.079  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.371   3.580  -0.300  1.00  0.00           C  
HETATM   21  C   UNL     1       1.680   4.615  -0.979  1.00  0.00           C  
HETATM   22  F   UNL     1       2.340   5.515  -1.740  1.00  0.00           F  
HETATM   23  O   UNL     1      -1.863   2.099   1.630  1.00  0.00           O  
HETATM   24  O   UNL     1       0.258   1.485   2.746  1.00  0.00           O  
HETATM   25  C   UNL     1       5.926  -0.673   0.693  1.00  0.00           C  
HETATM   26  C   UNL     1       5.234  -2.729  -0.546  1.00  0.00           C  
HETATM   27  F   UNL     1       5.468  -0.622  -1.655  1.00  0.00           F  
HETATM   28  F   UNL     1       4.827  -3.319   0.656  1.00  0.00           F  
HETATM   29  F   UNL     1       4.452  -3.221  -1.596  1.00  0.00           F  
HETATM   30  F   UNL     1       6.579  -3.035  -0.783  1.00  0.00           F  
HETATM   31  F   UNL     1       7.279  -0.836   0.376  1.00  0.00           F  
HETATM   32  F   UNL     1       5.653   0.686   0.882  1.00  0.00           F  
HETATM   33  F   UNL     1       5.634  -1.375   1.867  1.00  0.00           F  
HETATM   34  C   UNL     1      -3.884   0.305  -0.706  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.212  -0.120  -0.133  1.00  0.00           C  
HETATM   36  O   UNL     1      -3.847   1.013  -1.690  1.00  0.00           O  
HETATM   37  C   UNL     1      -6.336   0.664  -0.813  1.00  0.00           C  
HETATM   38  C   UNL     1      -7.683   0.233  -0.231  1.00  0.00           C  
HETATM   39  C   UNL     1      -7.887  -1.264  -0.474  1.00  0.00           C  
HETATM   40  C   UNL     1      -6.764  -2.049   0.207  1.00  0.00           C  
HETATM   41  C   UNL     1      -5.416  -1.617  -0.375  1.00  0.00           C  
HETATM   42  C   UNL     1      -9.215  -1.689   0.100  1.00  0.00           C  
HETATM   43  O   UNL     1      -9.608  -2.969   0.003  1.00  0.00           O  
HETATM   44  O   UNL     1      -9.925  -0.878   0.646  1.00  0.00           O  
HETATM   45  H   UNL     1      -0.929  -0.984   2.474  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.796  -2.056   1.041  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.123  -1.850   0.987  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.103  -0.339   1.937  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.310   1.145  -1.100  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.066  -1.914  -1.116  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.714  -0.934  -2.454  1.00  0.00           H  
HETATM   52  H   UNL     1       0.688  -1.548  -2.788  1.00  0.00           H  
HETATM   53  H   UNL     1       0.437   0.212  -2.703  1.00  0.00           H  
HETATM   54  H   UNL     1       3.016  -1.223  -2.208  1.00  0.00           H  
HETATM   55  H   UNL     1       3.921  -0.473   1.887  1.00  0.00           H  
HETATM   56  H   UNL     1       1.564   0.062   2.304  1.00  0.00           H  
HETATM   57  H   UNL     1       2.247   2.249   1.359  1.00  0.00           H  
HETATM   58  H   UNL     1       3.453   3.888  -0.027  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.243   5.130  -1.766  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.445   3.490  -0.378  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.226   0.080   0.938  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.190   1.731  -0.641  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.321   0.465  -1.884  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.697   0.433   0.840  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.484   0.792  -0.716  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.873  -1.464  -1.545  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.778  -1.849   1.278  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.909  -3.115   0.034  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.402  -1.817  -1.446  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.615  -2.176   0.109  1.00  0.00           H  
HETATM   71  H   UNL     1     -10.468  -3.194   0.386  1.00  0.00           H  
CONECT    1    2    5   45   46                                       
CONECT    2    1    3   47   48                                       
CONECT    3    2   34    4                                            
CONECT    4    5    3    6   49                                       
CONECT    5    1   15    9    4                                       
CONECT    6    4    7   50   51                                       
CONECT    7    8    6   52   53                                       
CONECT    8    9    9   10    7                                       
CONECT    9   13    5    8    8                                       
CONECT   10   11   11    8   54                                       
CONECT   11   12   14   10   10                                       
CONECT   12   13   13   11   55                                       
CONECT   13   12   12    9   56                                       
CONECT   14   25   11   26   27                                       
CONECT   15   23   23   24   24                                       
CONECT   15    5   16                                                 
CONECT   16   15   17   17   20                                       
CONECT   17   16   16   18   57                                       
CONECT   18   17   21   21   58                                       
CONECT   19   20   20   21   59                                       
CONECT   20   16   19   19   60                                       
CONECT   21   18   18   19   22                                       
CONECT   22   21                                                      
CONECT   23   15   15                                                 
CONECT   24   15   15                                                 
CONECT   25   32   31   33   14                                       
CONECT   26   28   14   29   30                                       
CONECT   27   14                                                      
CONECT   28   26                                                      
CONECT   29   26                                                      
CONECT   30   26                                                      
CONECT   31   25                                                      
CONECT   32   25                                                      
CONECT   33   25                                                      
CONECT   34   35    3   36   36                                       
CONECT   35   37   34   41   61                                       
CONECT   36   34   34                                                 
CONECT   37   38   35   62   63                                       
CONECT   38   37   39   64   65                                       
CONECT   39   38   42   40   66                                       
CONECT   40   39   41   67   68                                       
CONECT   41   35   40   69   70                                       
CONECT   42   44   44   43   39                                       
CONECT   43   42   71                                                 
CONECT   44   42   42                                                 
CONECT   45    1                                                      
CONECT   46    1                                                      
CONECT   47    2                                                      
CONECT   48    2                                                      
CONECT   49    4                                                      
CONECT   50    6                                                      
CONECT   51    6                                                      
CONECT   52    7                                                      
CONECT   53    7                                                      
CONECT   54   10                                                      
CONECT   55   12                                                      
CONECT   56   13                                                      
CONECT   57   17                                                      
CONECT   58   18                                                      
CONECT   59   19                                                      
CONECT   60   20                                                      
CONECT   61   35                                                      
CONECT   62   37                                                      
CONECT   63   37                                                      
CONECT   64   38                                                      
CONECT   65   38                                                      
CONECT   66   39                                                      
CONECT   67   40                                                      
CONECT   68   40                                                      
CONECT   69   41                                                      
CONECT   70   41                                                      
CONECT   71   43                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
