COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -8.288   2.495  -1.136  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.689   1.280  -0.476  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.323   1.087  -0.516  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.780  -0.044   0.100  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.653  -0.935   0.732  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.005  -0.666   0.724  1.00  0.00           C  
HETATM    7  N   UNL     1      -8.477   0.417   0.136  1.00  0.00           N  
HETATM    8  C   UNL     1      -4.318  -0.293   0.083  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.796  -1.428   0.703  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.439  -1.660   0.687  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.585  -0.758   0.050  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.107   0.378  -0.571  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.465   0.605  -0.559  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.125  -1.006   0.033  1.00  0.00           C  
HETATM   15  C   UNL     1       0.754   0.068   0.297  1.00  0.00           C  
HETATM   16  C   UNL     1       2.133  -0.161   0.282  1.00  0.00           C  
HETATM   17  C   UNL     1       2.582  -1.524  -0.012  1.00  0.00           C  
HETATM   18  C   UNL     1       3.941  -1.849  -0.048  1.00  0.00           C  
HETATM   19  C   UNL     1       4.321  -3.132  -0.325  1.00  0.00           C  
HETATM   20  C   UNL     1       3.367  -4.120  -0.572  1.00  0.00           C  
HETATM   21  C   UNL     1       2.037  -3.834  -0.544  1.00  0.00           C  
HETATM   22  C   UNL     1       1.610  -2.523  -0.261  1.00  0.00           C  
HETATM   23  N   UNL     1       0.310  -2.220  -0.222  1.00  0.00           N  
HETATM   24  F   UNL     1       5.634  -3.448  -0.361  1.00  0.00           F  
HETATM   25  C   UNL     1       3.093   0.923   0.550  1.00  0.00           C  
HETATM   26  O   UNL     1       3.463   1.140   1.688  1.00  0.00           O  
HETATM   27  N   UNL     1       3.563   1.673  -0.466  1.00  0.00           N  
HETATM   28  S   UNL     1       4.643   2.892  -0.165  1.00  0.00           S  
HETATM   29  O   UNL     1       4.887   3.467  -1.442  1.00  0.00           O  
HETATM   30  O   UNL     1       4.038   3.647   0.875  1.00  0.00           O  
HETATM   31  C   UNL     1       6.125   2.042   0.445  1.00  0.00           C  
HETATM   32  N   UNL     1       0.257   1.331   0.566  1.00  0.00           N  
HETATM   33  H   UNL     1      -8.531   2.263  -2.173  1.00  0.00           H  
HETATM   34  H   UNL     1      -9.194   2.786  -0.606  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.570   3.315  -1.106  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.683   1.800  -1.015  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.273  -1.821   1.219  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.687  -1.348   1.210  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.457  -2.125   1.197  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.870   1.482  -1.042  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.035  -2.538   1.168  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.447   1.076  -1.064  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.695   1.458   0.704  1.00  0.00           H  
HETATM   44  H   UNL     1       0.860   2.089   0.617  1.00  0.00           H  
HETATM   45  H   UNL     1       4.687  -1.092   0.141  1.00  0.00           H  
HETATM   46  H   UNL     1       3.689  -5.128  -0.790  1.00  0.00           H  
HETATM   47  H   UNL     1       1.311  -4.610  -0.738  1.00  0.00           H  
HETATM   48  H   UNL     1       3.268   1.500  -1.374  1.00  0.00           H  
HETATM   49  H   UNL     1       6.490   1.355  -0.319  1.00  0.00           H  
HETATM   50  H   UNL     1       6.898   2.777   0.671  1.00  0.00           H  
HETATM   51  H   UNL     1       5.878   1.485   1.348  1.00  0.00           H  
CONECT    1    2   33   34   35                                       
CONECT    2    1    3    7    7                                       
CONECT    3    2    4    4   36                                       
CONECT    4    3    3    5    8                                       
CONECT    5    4    6    6   37                                       
CONECT    6    5    5    7   38                                       
CONECT    7    2    2    6                                            
CONECT    8    4    9   13   13                                       
CONECT    9    8   10   10   39                                       
CONECT   10    9    9   11   41                                       
CONECT   11   10   12   12   14                                       
CONECT   12   11   11   13   42                                       
CONECT   13    8    8   12   40                                       
CONECT   14   11   15   23   23                                       
CONECT   15   14   16   16   32                                       
CONECT   16   15   15   17   25                                       
CONECT   17   16   18   22   22                                       
CONECT   18   17   19   19   45                                       
CONECT   19   18   18   20   24                                       
CONECT   20   19   21   21   46                                       
CONECT   21   20   20   22   47                                       
CONECT   22   17   17   21   23                                       
CONECT   23   14   14   22                                            
CONECT   24   19                                                      
CONECT   25   16   26   26   27                                       
CONECT   26   25   25                                                 
CONECT   27   25   28   48                                            
CONECT   28   27   29   29   30                                       
CONECT   28   30   31                                                 
CONECT   29   28   28                                                 
CONECT   30   28   28                                                 
CONECT   31   28   49   50   51                                       
CONECT   32   15   43   44                                            
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    9                                                      
CONECT   40   13                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   32                                                      
CONECT   44   32                                                      
CONECT   45   18                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   27                                                      
CONECT   49   31                                                      
CONECT   50   31                                                      
CONECT   51   31                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
