COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.929  -5.205  -0.412  1.00  0.00           O  
HETATM    2  C   UNL     1       7.171  -3.895  -0.243  1.00  0.00           C  
HETATM    3  O   UNL     1       8.305  -3.480  -0.280  1.00  0.00           O  
HETATM    4  C   UNL     1       6.027  -2.942  -0.007  1.00  0.00           C  
HETATM    5  O   UNL     1       6.536  -1.615   0.141  1.00  0.00           O  
HETATM    6  C   UNL     1       5.628  -0.627   0.362  1.00  0.00           C  
HETATM    7  C   UNL     1       4.276  -0.931   0.434  1.00  0.00           C  
HETATM    8  C   UNL     1       3.354   0.071   0.657  1.00  0.00           C  
HETATM    9  C   UNL     1       6.055   0.683   0.521  1.00  0.00           C  
HETATM   10  C   UNL     1       7.524   1.011   0.449  1.00  0.00           C  
HETATM   11  C   UNL     1       5.134   1.687   0.745  1.00  0.00           C  
HETATM   12  C   UNL     1       5.597   3.111   0.918  1.00  0.00           C  
HETATM   13  C   UNL     1       3.780   1.385   0.811  1.00  0.00           C  
HETATM   14  S   UNL     1       2.603   2.665   1.097  1.00  0.00           S  
HETATM   15  C   UNL     1       1.060   1.829   0.935  1.00  0.00           C  
HETATM   16  C   UNL     1       0.325   1.501   2.066  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.885   0.845   1.936  1.00  0.00           C  
HETATM   18  C   UNL     1       0.572   1.501  -0.329  1.00  0.00           C  
HETATM   19  O   UNL     1       1.286   1.825  -1.440  1.00  0.00           O  
HETATM   20  C   UNL     1       0.724   1.457  -2.701  1.00  0.00           C  
HETATM   21  C   UNL     1       1.626   1.883  -3.784  1.00  0.00           C  
HETATM   22  C   UNL     1       2.346   2.224  -4.647  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.641   0.844  -0.449  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.365   0.515   0.682  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.685  -0.200   0.548  1.00  0.00           C  
HETATM   26  O   UNL     1      -3.737   0.760   0.436  1.00  0.00           O  
HETATM   27  C   UNL     1      -5.001   0.278   0.307  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.071   1.154   0.194  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.355   0.661   0.062  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.223  -1.092   0.282  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.509  -1.579   0.150  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.574  -0.704   0.043  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.976  -1.239  -0.101  1.00  0.00           C  
HETATM   34  F   UNL     1      -9.543  -1.408   1.167  1.00  0.00           F  
HETATM   35  F   UNL     1      -9.746  -0.336  -0.840  1.00  0.00           F  
HETATM   36  F   UNL     1      -8.939  -2.471  -0.762  1.00  0.00           F  
HETATM   37  H   UNL     1       7.695  -5.777  -0.561  1.00  0.00           H  
HETATM   38  H   UNL     1       5.345  -2.977  -0.857  1.00  0.00           H  
HETATM   39  H   UNL     1       5.495  -3.231   0.899  1.00  0.00           H  
HETATM   40  H   UNL     1       3.946  -1.952   0.314  1.00  0.00           H  
HETATM   41  H   UNL     1       2.301  -0.166   0.712  1.00  0.00           H  
HETATM   42  H   UNL     1       7.795   1.240  -0.582  1.00  0.00           H  
HETATM   43  H   UNL     1       7.735   1.874   1.081  1.00  0.00           H  
HETATM   44  H   UNL     1       8.104   0.156   0.795  1.00  0.00           H  
HETATM   45  H   UNL     1       5.626   3.604  -0.053  1.00  0.00           H  
HETATM   46  H   UNL     1       4.907   3.641   1.574  1.00  0.00           H  
HETATM   47  H   UNL     1       6.595   3.117   1.359  1.00  0.00           H  
HETATM   48  H   UNL     1       0.698   1.757   3.046  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.456   0.590   2.816  1.00  0.00           H  
HETATM   50  H   UNL     1       0.596   0.375  -2.741  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.244   1.942  -2.823  1.00  0.00           H  
HETATM   52  H   UNL     1       2.990   2.528  -5.418  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.021   0.589  -1.427  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.669  -0.827  -0.344  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.852  -0.822   1.427  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.901   2.220   0.210  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.188   1.342  -0.026  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.392  -1.776   0.365  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.682  -2.645   0.130  1.00  0.00           H  
CONECT    1    2   37                                                 
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   38   39                                       
CONECT    5    4    6                                                 
CONECT    6    5    9    9    7                                       
CONECT    7    6    8    8   40                                       
CONECT    8    7    7   13   41                                       
CONECT    9    6    6   10   11                                       
CONECT   10    9   42   43   44                                       
CONECT   11    9   12   13   13                                       
CONECT   12   11   45   46   47                                       
CONECT   13    8   11   11   14                                       
CONECT   14   13   15                                                 
CONECT   15   14   18   18   16                                       
CONECT   16   15   17   17   48                                       
CONECT   17   16   16   24   49                                       
CONECT   18   15   15   19   23                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   50   51                                       
CONECT   21   20   22   22   22                                       
CONECT   22   21   21   21   52                                       
CONECT   23   18   24   24   53                                       
CONECT   24   17   23   23   25                                       
CONECT   25   24   26   54   55                                       
CONECT   26   25   27                                                 
CONECT   27   26   30   30   28                                       
CONECT   28   27   29   29   56                                       
CONECT   29   28   28   32   57                                       
CONECT   30   27   27   31   58                                       
CONECT   31   30   32   32   59                                       
CONECT   32   29   31   31   33                                       
CONECT   33   32   35   36   34                                       
CONECT   34   33                                                      
CONECT   35   33                                                      
CONECT   36   33                                                      
CONECT   37    1                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   25                                                      
CONECT   55   25                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
