COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.867  -2.470  -0.103  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.648  -2.875   1.371  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.480   5.981  -0.147  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.822   4.896   0.177  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.523   3.779   0.906  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.058   2.593  -1.136  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.822   1.377   0.945  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.419   0.099   0.254  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.115  -1.636  -0.236  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.758  -1.610   0.799  1.00  0.00           C  
HETATM   11  C   UNL     1       0.705  -1.690   0.448  1.00  0.00           C  
HETATM   12  C   UNL     1       2.754  -1.252   0.122  1.00  0.00           C  
HETATM   13  C   UNL     1       4.059  -0.550   0.041  1.00  0.00           C  
HETATM   14  C   UNL     1       4.160   0.786   0.424  1.00  0.00           C  
HETATM   15  C   UNL     1       5.376   1.434   0.346  1.00  0.00           C  
HETATM   16  C   UNL     1       6.494   0.760  -0.112  1.00  0.00           C  
HETATM   17  C   UNL     1       7.819   1.472  -0.194  1.00  0.00           C  
HETATM   18  C   UNL     1       6.399  -0.567  -0.493  1.00  0.00           C  
HETATM   19  C   UNL     1       5.189  -1.226  -0.414  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.624  -1.637  -0.479  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.116  -1.959  -1.061  1.00  0.00           C  
HETATM   22  F   UNL     1       8.507   1.317   1.014  1.00  0.00           F  
HETATM   23  F   UNL     1       8.577   0.928  -1.236  1.00  0.00           F  
HETATM   24  F   UNL     1       7.602   2.833  -0.436  1.00  0.00           F  
HETATM   25  N   UNL     1      -5.361   2.527   0.156  1.00  0.00           N  
HETATM   26  N   UNL     1      -4.310  -0.530   0.453  1.00  0.00           N  
HETATM   27  N   UNL     1      -1.175  -2.815   1.560  1.00  0.00           N  
HETATM   28  N   UNL     1       1.583  -0.722   0.542  1.00  0.00           N  
HETATM   29  N   UNL     1       2.522  -2.499  -0.196  1.00  0.00           N  
HETATM   30  O   UNL     1      -2.956  -3.631  -0.931  1.00  0.00           O  
HETATM   31  O   UNL     1       1.353  -2.765  -0.014  1.00  0.00           O  
HETATM   32  S   UNL     1      -6.368  -0.730  -0.902  1.00  0.00           S  
HETATM   33  H   UNL     1      -3.145  -2.170   2.037  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.014  -3.886   1.545  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.978   6.782  -0.670  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.526   6.075   0.108  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.777   4.802  -0.077  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.090   3.666   1.900  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.584   4.014   0.997  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.130   2.693  -0.965  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.697   3.453  -1.699  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.864   1.681  -1.701  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.908   1.412   1.038  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.371   1.411   1.936  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.960  -0.707   1.376  1.00  0.00           H  
HETATM   46  H   UNL     1       3.287   1.313   0.781  1.00  0.00           H  
HETATM   47  H   UNL     1       5.455   2.469   0.643  1.00  0.00           H  
HETATM   48  H   UNL     1       7.275  -1.088  -0.850  1.00  0.00           H  
HETATM   49  H   UNL     1       5.118  -2.263  -0.709  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.080  -2.115  -1.294  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.916  -0.626  -0.760  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.152  -2.823  -1.708  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.940  -2.725   2.537  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.707  -4.204  -0.725  1.00  0.00           H  
CONECT    1   30    2    9   20                                       
CONECT    2    1   27   33   34                                       
CONECT    3    4    4   35   36                                       
CONECT    4    3    3    5   37                                       
CONECT    5    4   25   38   39                                       
CONECT    6   25   40   41   42                                       
CONECT    7   25    8   43   44                                       
CONECT    8    7   26   26   32                                       
CONECT    9   26    1   21   21                                       
CONECT   10   27   11   20   45                                       
CONECT   11   28   28   10   31                                       
CONECT   12   28   13   29   29                                       
CONECT   13   14   14   12   19                                       
CONECT   14   13   13   15   46                                       
CONECT   15   14   16   16   47                                       
CONECT   16   15   15   17   18                                       
CONECT   17   22   23   24   16                                       
CONECT   18   16   19   19   48                                       
CONECT   19   18   18   13   49                                       
CONECT   20   10    1   50   51                                       
CONECT   21    9    9   32   52                                       
CONECT   22   17                                                      
CONECT   23   17                                                      
CONECT   24   17                                                      
CONECT   25    5    6    7                                            
CONECT   26    8    8    9                                            
CONECT   27    2   10   53                                            
CONECT   28   11   11   12                                            
CONECT   29   12   12   31                                            
CONECT   30    1   54                                                 
CONECT   31   29   11                                                 
CONECT   32   21    8                                                 
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45   10                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   27                                                      
CONECT   54   30                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
