COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.826  -4.064  -1.082  1.00  0.00           C  
HETATM    2  C   UNL     1       3.314  -4.233  -1.247  1.00  0.00           C  
HETATM    3  C   UNL     1       2.599  -3.006  -0.680  1.00  0.00           C  
HETATM    4  S   UNL     1       0.810  -3.206  -0.875  1.00  0.00           S  
HETATM    5  C   UNL     1       0.254  -1.695  -0.160  1.00  0.00           C  
HETATM    6  N   UNL     1       1.153  -0.838   0.311  1.00  0.00           N  
HETATM    7  C   UNL     1       0.785   0.313   0.858  1.00  0.00           C  
HETATM    8  N   UNL     1       1.729   1.197   1.344  1.00  0.00           N  
HETATM    9  C   UNL     1       3.154   0.867   1.258  1.00  0.00           C  
HETATM   10  C   UNL     1       4.020   1.148   2.488  1.00  0.00           C  
HETATM   11  C   UNL     1       4.149   2.029   1.243  1.00  0.00           C  
HETATM   12  C   UNL     1       5.391   1.872   0.405  1.00  0.00           C  
HETATM   13  C   UNL     1       5.646   2.759  -0.624  1.00  0.00           C  
HETATM   14  C   UNL     1       6.785   2.617  -1.395  1.00  0.00           C  
HETATM   15  C   UNL     1       7.671   1.585  -1.136  1.00  0.00           C  
HETATM   16  F   UNL     1       8.784   1.445  -1.889  1.00  0.00           F  
HETATM   17  C   UNL     1       7.414   0.695  -0.104  1.00  0.00           C  
HETATM   18  F   UNL     1       8.278  -0.313   0.149  1.00  0.00           F  
HETATM   19  C   UNL     1       6.276   0.844   0.669  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.591   0.616   0.933  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.294   1.658   1.409  1.00  0.00           N  
HETATM   22  N   UNL     1      -2.555   1.455   1.242  1.00  0.00           N  
HETATM   23  N   UNL     1      -2.747   0.213   0.619  1.00  0.00           N  
HETATM   24  C   UNL     1      -4.029  -0.393   0.251  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.808   0.533  -0.716  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.277   0.085  -0.509  1.00  0.00           C  
HETATM   27  O   UNL     1      -7.176   1.132  -0.878  1.00  0.00           O  
HETATM   28  C   UNL     1      -8.436   0.670  -1.370  1.00  0.00           C  
HETATM   29  C   UNL     1      -9.313   1.870  -1.732  1.00  0.00           C  
HETATM   30  O   UNL     1      -8.721   2.582  -2.820  1.00  0.00           O  
HETATM   31  C   UNL     1      -6.375  -0.204   1.003  1.00  0.00           C  
HETATM   32  O   UNL     1      -7.220  -1.334   1.232  1.00  0.00           O  
HETATM   33  C   UNL     1      -4.946  -0.507   1.487  1.00  0.00           C  
HETATM   34  O   UNL     1      -4.881  -1.830   2.023  1.00  0.00           O  
HETATM   35  C   UNL     1      -1.504  -0.322   0.422  1.00  0.00           C  
HETATM   36  N   UNL     1      -1.046  -1.450  -0.115  1.00  0.00           N  
HETATM   37  H   UNL     1       5.067  -3.959  -0.024  1.00  0.00           H  
HETATM   38  H   UNL     1       5.336  -4.939  -1.486  1.00  0.00           H  
HETATM   39  H   UNL     1       5.152  -3.173  -1.619  1.00  0.00           H  
HETATM   40  H   UNL     1       3.073  -4.338  -2.305  1.00  0.00           H  
HETATM   41  H   UNL     1       2.988  -5.124  -0.710  1.00  0.00           H  
HETATM   42  H   UNL     1       2.839  -2.901   0.378  1.00  0.00           H  
HETATM   43  H   UNL     1       2.925  -2.115  -1.217  1.00  0.00           H  
HETATM   44  H   UNL     1       1.449   2.036   1.742  1.00  0.00           H  
HETATM   45  H   UNL     1       3.398  -0.012   0.661  1.00  0.00           H  
HETATM   46  H   UNL     1       3.529   1.579   3.361  1.00  0.00           H  
HETATM   47  H   UNL     1       4.833   0.455   2.700  1.00  0.00           H  
HETATM   48  H   UNL     1       3.743   3.039   1.298  1.00  0.00           H  
HETATM   49  H   UNL     1       4.955   3.564  -0.826  1.00  0.00           H  
HETATM   50  H   UNL     1       6.078   0.154   1.476  1.00  0.00           H  
HETATM   51  H   UNL     1       6.983   3.310  -2.198  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.872  -1.372  -0.202  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.681   1.579  -0.436  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.495   0.367  -1.746  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.646   0.218   2.243  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.485  -0.817  -1.086  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.769   0.668   1.525  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.277   0.056  -2.256  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.931   0.077  -0.600  1.00  0.00           H  
HETATM   60  H   UNL     1     -10.304   1.521  -2.022  1.00  0.00           H  
HETATM   61  H   UNL     1      -9.399   2.531  -0.869  1.00  0.00           H  
HETATM   62  H   UNL     1      -9.224   3.357  -3.104  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.322  -1.566   2.165  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.437  -1.966   2.803  1.00  0.00           H  
CONECT    1    2   37   38   39                                       
CONECT    2    1    3   40   41                                       
CONECT    3    2    4   42   43                                       
CONECT    4    3    5                                                 
CONECT    5    4    6   36   36                                       
CONECT    6    5    7    7                                            
CONECT    7    6    6    8   20                                       
CONECT    8    7    9   44                                            
CONECT    9    8   10   11   45                                       
CONECT   10    9   11   46   47                                       
CONECT   11    9   10   12   48                                       
CONECT   12   11   13   19   19                                       
CONECT   13   12   14   14   49                                       
CONECT   14   13   13   15   51                                       
CONECT   15   14   16   17   17                                       
CONECT   16   15                                                      
CONECT   17   15   15   18   19                                       
CONECT   18   17                                                      
CONECT   19   12   12   17   50                                       
CONECT   20    7   21   35   35                                       
CONECT   21   20   22   22                                            
CONECT   22   21   21   23                                            
CONECT   23   22   24   35                                            
CONECT   24   23   25   33   52                                       
CONECT   25   24   26   53   54                                       
CONECT   26   25   27   31   56                                       
CONECT   27   26   28                                                 
CONECT   28   27   29   58   59                                       
CONECT   29   28   30   60   61                                       
CONECT   30   29   62                                                 
CONECT   31   26   32   33   57                                       
CONECT   32   31   63                                                 
CONECT   33   24   31   34   55                                       
CONECT   34   33   64                                                 
CONECT   35   20   20   23   36                                       
CONECT   36    5    5   35                                            
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   13                                                      
CONECT   50   19                                                      
CONECT   51   14                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   33                                                      
CONECT   56   26                                                      
CONECT   57   31                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   30                                                      
CONECT   63   32                                                      
CONECT   64   34                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
