COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.037  -0.013   1.167  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.846   2.229  -1.137  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.737   0.878  -0.544  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.551   0.312   0.269  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.015  -2.886   0.338  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.404  -1.772  -0.515  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.572  -0.433   0.210  1.00  0.00           C  
HETATM    8  C   UNL     1      -8.607  -1.376   1.306  1.00  0.00           C  
HETATM    9  C   UNL     1       2.614   5.002  -1.469  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.191   0.308   0.712  1.00  0.00           N  
HETATM   11  O   UNL     1       2.251   4.965   1.174  1.00  0.00           O  
HETATM   12  S   UNL     1       3.221   4.616   0.197  1.00  0.00           S  
HETATM   13  C   UNL     1       3.276   2.856   0.248  1.00  0.00           C  
HETATM   14  O   UNL     1       4.578   5.013   0.337  1.00  0.00           O  
HETATM   15  C   UNL     1       4.427   2.190  -0.139  1.00  0.00           C  
HETATM   16  O   UNL     1       3.434  -1.273   0.357  1.00  0.00           O  
HETATM   17  C   UNL     1       4.482   0.811  -0.103  1.00  0.00           C  
HETATM   18  O   UNL     1       1.174  -0.935   1.947  1.00  0.00           O  
HETATM   19  C   UNL     1       3.382   0.082   0.322  1.00  0.00           C  
HETATM   20  O   UNL     1      -6.071   0.623  -0.612  1.00  0.00           O  
HETATM   21  C   UNL     1       4.656  -1.886  -0.058  1.00  0.00           C  
HETATM   22  O   UNL     1      -8.391  -2.593   0.589  1.00  0.00           O  
HETATM   23  C   UNL     1       4.526  -3.407   0.049  1.00  0.00           C  
HETATM   24  C   UNL     1       3.385  -3.886  -0.849  1.00  0.00           C  
HETATM   25  C   UNL     1       2.214   0.752   0.714  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.533   1.442  -0.151  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.021   1.398  -0.398  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.202   1.973  -1.210  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.908   0.046   0.191  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.439  -0.412   0.985  1.00  0.00           C  
HETATM   31  C   UNL     1       2.174   2.148   0.678  1.00  0.00           C  
HETATM   32  C   UNL     1      -8.060  -0.201   0.491  1.00  0.00           C  
HETATM   33  F   UNL     1       5.723  -4.007  -0.357  1.00  0.00           F  
HETATM   34  F   UNL     1       4.255  -3.759   1.376  1.00  0.00           F  
HETATM   35  F   UNL     1       3.656  -3.533  -2.176  1.00  0.00           F  
HETATM   36  F   UNL     1       3.266  -5.276  -0.751  1.00  0.00           F  
HETATM   37  F   UNL     1       2.188  -3.285  -0.443  1.00  0.00           F  
HETATM   38  F   UNL     1      -5.007   2.788  -1.928  1.00  0.00           F  
HETATM   39  H   UNL     1      -2.430   3.080  -1.655  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.936  -3.835  -0.192  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.479  -2.954   1.286  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.343  -1.971  -0.670  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.911  -1.731  -1.479  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.023  -0.457   1.151  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.675  -1.237   1.473  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.092  -1.424   2.266  1.00  0.00           H  
HETATM   47  H   UNL     1       2.549   6.083  -1.590  1.00  0.00           H  
HETATM   48  H   UNL     1       3.302   4.595  -2.210  1.00  0.00           H  
HETATM   49  H   UNL     1       1.628   4.560  -1.607  1.00  0.00           H  
HETATM   50  H   UNL     1       5.287   2.753  -0.471  1.00  0.00           H  
HETATM   51  H   UNL     1       5.384   0.299  -0.406  1.00  0.00           H  
HETATM   52  H   UNL     1       4.868  -1.611  -1.091  1.00  0.00           H  
HETATM   53  H   UNL     1       5.470  -1.545   0.582  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.270   2.377   0.344  1.00  0.00           H  
HETATM   55  H   UNL     1       0.002   1.361  -1.097  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.322  -0.804   0.713  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.635  -0.419   2.057  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.363  -1.435   0.615  1.00  0.00           H  
HETATM   59  H   UNL     1       1.280   2.671   0.982  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.184   0.723   1.056  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.602  -0.128  -0.452  1.00  0.00           H  
CONECT    1   25   18   18   10                                       
CONECT    2   27   28   28   39                                       
CONECT    3   29   29   28   20                                       
CONECT    4   30   27   27   29                                       
CONECT    5    6   22   40   41                                       
CONECT    6    7    5   42   43                                       
CONECT    7   20   32    6   44                                       
CONECT    8   32   22   45   46                                       
CONECT    9   12   47   48   49                                       
CONECT   10    1   26   30                                            
CONECT   11   12   12                                                 
CONECT   12   14   14   11   11                                       
CONECT   12    9   13                                                 
CONECT   13   12   15   15   31                                       
CONECT   14   12   12                                                 
CONECT   15   13   13   17   50                                       
CONECT   16   19   21                                                 
CONECT   17   15   19   19   51                                       
CONECT   18    1    1                                                 
CONECT   19   17   17   25   16                                       
CONECT   20    3    7                                                 
CONECT   21   16   23   52   53                                       
CONECT   22    8    5                                                 
CONECT   23   21   24   34   33                                       
CONECT   24   36   37   23   35                                       
CONECT   25   31   31   19    1                                       
CONECT   26   10   27   54   55                                       
CONECT   27   26    4    4    2                                       
CONECT   28    2    2    3   38                                       
CONECT   29    4    3    3   56                                       
CONECT   30   10    4   57   58                                       
CONECT   31   13   25   25   59                                       
CONECT   32    7    8   60   61                                       
CONECT   33   23                                                      
CONECT   34   23                                                      
CONECT   35   24                                                      
CONECT   36   24                                                      
CONECT   37   24                                                      
CONECT   38   28                                                      
CONECT   39    2                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49    9                                                      
CONECT   50   15                                                      
CONECT   51   17                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   26                                                      
CONECT   55   26                                                      
CONECT   56   29                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   32                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
