COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.537  -0.925  -0.078  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.219   0.916  -0.624  1.00  0.00           C  
HETATM    3  C   UNL     1       3.207  -0.288  -0.159  1.00  0.00           C  
HETATM    4  C   UNL     1       2.056  -1.078  -0.229  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.619   1.546  -0.390  1.00  0.00           C  
HETATM    6  C   UNL     1       0.822  -0.485  -0.304  1.00  0.00           C  
HETATM    7  C   UNL     1       0.715   0.907  -0.309  1.00  0.00           C  
HETATM    8  C   UNL     1       1.864   1.697  -0.239  1.00  0.00           C  
HETATM    9  C   UNL     1       3.099   1.106  -0.158  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.793   2.885  -0.399  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.844   1.525  -0.535  1.00  0.00           C  
HETATM   12  N   UNL     1       5.646  -0.162  -0.010  1.00  0.00           N  
HETATM   13  N   UNL     1      -4.750   0.709   0.725  1.00  0.00           N  
HETATM   14  C   UNL     1       6.965  -0.795   0.069  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.747   0.854  -0.464  1.00  0.00           N  
HETATM   16  F   UNL     1       9.629  -1.169  -0.914  1.00  0.00           F  
HETATM   17  C   UNL     1       9.424  -0.374   0.219  1.00  0.00           C  
HETATM   18  F   UNL     1       9.490  -1.171   1.367  1.00  0.00           F  
HETATM   19  F   UNL     1      10.411   0.615   0.280  1.00  0.00           F  
HETATM   20  C   UNL     1       8.046   0.287   0.136  1.00  0.00           C  
HETATM   21  O   UNL     1       4.630  -2.137  -0.069  1.00  0.00           O  
HETATM   22  S   UNL     1      -2.523   3.204  -0.504  1.00  0.00           S  
HETATM   23  S   UNL     1      -6.364   0.406   0.943  1.00  0.00           S  
HETATM   24  O   UNL     1      -6.552   0.220   2.339  1.00  0.00           O  
HETATM   25  O   UNL     1      -7.061   1.388   0.189  1.00  0.00           O  
HETATM   26  C   UNL     1      -6.711  -1.145   0.183  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.085  -1.194  -1.147  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.353  -2.412  -1.745  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.245  -3.579  -1.013  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.869  -3.530   0.316  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.603  -2.313   0.914  1.00  0.00           C  
HETATM   32  H   UNL     1      -4.879   1.587  -1.175  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.160  -0.041  -1.142  1.00  0.00           H  
HETATM   34  H   UNL     1       2.139  -2.154  -0.225  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.067  -1.095  -0.359  1.00  0.00           H  
HETATM   36  H   UNL     1       1.780   2.773  -0.244  1.00  0.00           H  
HETATM   37  H   UNL     1       3.987   1.717  -0.104  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.011   3.628  -0.351  1.00  0.00           H  
HETATM   39  H   UNL     1       5.571   0.805  -0.014  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.156   0.749   1.491  1.00  0.00           H  
HETATM   41  H   UNL     1       7.017  -1.416   0.964  1.00  0.00           H  
HETATM   42  H   UNL     1       7.125  -1.414  -0.813  1.00  0.00           H  
HETATM   43  H   UNL     1       7.994   0.908  -0.758  1.00  0.00           H  
HETATM   44  H   UNL     1       7.886   0.906   1.018  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.169  -0.282  -1.719  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.646  -2.450  -2.784  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.454  -4.530  -1.480  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.785  -4.443   0.888  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.306  -2.274   1.952  1.00  0.00           H  
CONECT    1   21   21    3   12                                       
CONECT    2   13   11   32   33                                       
CONECT    3    9    1    4    4                                       
CONECT    4    3    3    6   34                                       
CONECT    5   15    7   10   10                                       
CONECT    6    7    7    4   35                                       
CONECT    7    8    5    6    6                                       
CONECT    8    9    9    7   36                                       
CONECT    9    8    8    3   37                                       
CONECT   10    5    5   22   38                                       
CONECT   11   15   15    2   22                                       
CONECT   12    1   14   39                                            
CONECT   13    2   23   40                                            
CONECT   14   20   12   41   42                                       
CONECT   15   11   11    5                                            
CONECT   16   17                                                      
CONECT   17   18   19   16   20                                       
CONECT   18   17                                                      
CONECT   19   17                                                      
CONECT   20   17   14   43   44                                       
CONECT   21    1    1                                                 
CONECT   22   11   10                                                 
CONECT   23   13   26   24   24                                       
CONECT   23   25   25                                                 
CONECT   24   23   23                                                 
CONECT   25   23   23                                                 
CONECT   26   27   27   31   23                                       
CONECT   27   28   26   26   45                                       
CONECT   28   29   29   27   46                                       
CONECT   29   28   28   30   47                                       
CONECT   30   29   31   31   48                                       
CONECT   31   30   30   26   49                                       
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   27                                                      
CONECT   46   28                                                      
CONECT   47   29                                                      
CONECT   48   30                                                      
CONECT   49   31                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
