COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.551  -0.428   0.223  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.485   0.720  -1.299  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.769   0.883   0.044  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.638  -0.154   1.422  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.386  -1.073   1.437  1.00  0.00           C  
HETATM    6  C   UNL     1       4.431   3.622   0.408  1.00  0.00           C  
HETATM    7  C   UNL     1       5.074  -0.498  -0.434  1.00  0.00           C  
HETATM    8  C   UNL     1       4.196  -1.578  -0.140  1.00  0.00           C  
HETATM    9  C   UNL     1       5.709   3.092   0.484  1.00  0.00           C  
HETATM   10  N   UNL     1       0.301  -1.371   1.281  1.00  0.00           N  
HETATM   11  C   UNL     1       4.850   0.940  -0.140  1.00  0.00           C  
HETATM   12  C   UNL     1       3.362   2.813   0.059  1.00  0.00           C  
HETATM   13  C   UNL     1       0.551  -1.281  -0.017  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.925  -1.308   1.757  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.013  -1.143   0.900  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.783  -1.044  -0.480  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.482  -1.115  -0.934  1.00  0.00           C  
HETATM   18  N   UNL     1       6.123  -1.028  -1.012  1.00  0.00           N  
HETATM   19  C   UNL     1       4.375  -4.095  -0.547  1.00  0.00           C  
HETATM   20  O   UNL     1       6.014  -2.229  -1.108  1.00  0.00           O  
HETATM   21  C   UNL     1       4.852  -2.666  -0.601  1.00  0.00           C  
HETATM   22  C   UNL     1       2.848  -1.522   0.532  1.00  0.00           C  
HETATM   23  C   UNL     1       3.566   1.476  -0.215  1.00  0.00           C  
HETATM   24  C   UNL     1       5.922   1.757   0.211  1.00  0.00           C  
HETATM   25  F   UNL     1       4.226   4.929   0.681  1.00  0.00           F  
HETATM   26  N   UNL     1      -4.243  -0.138   0.979  1.00  0.00           N  
HETATM   27  O   UNL     1       1.830  -1.351  -0.457  1.00  0.00           O  
HETATM   28  O   UNL     1      -3.745  -1.860   2.292  1.00  0.00           O  
HETATM   29  O   UNL     1      -6.944   0.473  -2.228  1.00  0.00           O  
HETATM   30  O   UNL     1      -6.556   2.124  -0.456  1.00  0.00           O  
HETATM   31  S   UNL     1      -6.277   0.856  -1.033  1.00  0.00           S  
HETATM   32  H   UNL     1      -6.318  -1.406  -0.198  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.593  -0.406   0.545  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.157   1.501  -1.985  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.252  -0.259  -1.720  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.694   0.772  -0.101  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.980   1.873   0.450  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.891   0.812   1.859  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.773  -0.937   2.168  1.00  0.00           H  
HETATM   40  H   UNL     1       6.540   3.726   0.756  1.00  0.00           H  
HETATM   41  H   UNL     1       2.367   3.229   0.002  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.089  -1.386   2.822  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.604  -0.916  -1.170  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.268  -1.042  -1.990  1.00  0.00           H  
HETATM   45  H   UNL     1       5.128  -4.746  -0.990  1.00  0.00           H  
HETATM   46  H   UNL     1       4.211  -4.384   0.491  1.00  0.00           H  
HETATM   47  H   UNL     1       3.442  -4.187  -1.102  1.00  0.00           H  
HETATM   48  H   UNL     1       2.674  -2.450   1.076  1.00  0.00           H  
HETATM   49  H   UNL     1       2.823  -0.683   1.227  1.00  0.00           H  
HETATM   50  H   UNL     1       2.732   0.846  -0.488  1.00  0.00           H  
HETATM   51  H   UNL     1       6.919   1.345   0.270  1.00  0.00           H  
CONECT    1    4   31   32   33                                       
CONECT    2    3   31   34   35                                       
CONECT    3   26    2   36   37                                       
CONECT    4    1   26   38   39                                       
CONECT    5   15   28   28   26                                       
CONECT    6   12   25    9    9                                       
CONECT    7   18   18   11    8                                       
CONECT    8    7   21   21   22                                       
CONECT    9    6    6   24   40                                       
CONECT   10   13   14   14                                            
CONECT   11   23    7   24   24                                       
CONECT   12   23   23    6   41                                       
CONECT   13   27   17   17   10                                       
CONECT   14   10   10   15   42                                       
CONECT   15   16   16   14    5                                       
CONECT   16   17   15   15   43                                       
CONECT   17   13   13   16   44                                       
CONECT   18   20    7    7                                            
CONECT   19   21   45   46   47                                       
CONECT   20   18   21                                                 
CONECT   21   20    8    8   19                                       
CONECT   22    8   27   48   49                                       
CONECT   23   12   12   11   50                                       
CONECT   24   11   11    9   51                                       
CONECT   25    6                                                      
CONECT   26    5    4    3                                            
CONECT   27   22   13                                                 
CONECT   28    5    5                                                 
CONECT   29   31   31                                                 
CONECT   30   31   31                                                 
CONECT   31    1   29   29    2                                       
CONECT   31   30   30                                                 
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    9                                                      
CONECT   41   12                                                      
CONECT   42   14                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
