COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -9.491  -2.539  -0.224  1.00  0.00           F  
HETATM    2  C   UNL     1      -8.524  -3.291   0.452  1.00  0.00           C  
HETATM    3  F   UNL     1      -8.435  -2.852   1.778  1.00  0.00           F  
HETATM    4  F   UNL     1      -8.885  -4.642   0.431  1.00  0.00           F  
HETATM    5  O   UNL     1      -7.258  -3.125  -0.190  1.00  0.00           O  
HETATM    6  C   UNL     1      -6.760  -1.862  -0.256  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.535  -1.631  -0.866  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.028  -0.348  -0.932  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.744   0.711  -0.389  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.970   0.478   0.221  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.478  -0.804   0.282  1.00  0.00           C  
HETATM   12  N   UNL     1      -5.230   2.012  -0.456  1.00  0.00           N  
HETATM   13  C   UNL     1      -3.902   2.219  -0.352  1.00  0.00           C  
HETATM   14  O   UNL     1      -3.143   1.271  -0.288  1.00  0.00           O  
HETATM   15  N   UNL     1      -3.416   3.475  -0.320  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.031   3.691  -0.313  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.495   4.785  -0.979  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.131   4.997  -0.972  1.00  0.00           C  
HETATM   19  C   UNL     1       0.705   4.117  -0.298  1.00  0.00           C  
HETATM   20  C   UNL     1       0.169   3.023   0.368  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.196   2.813   0.366  1.00  0.00           C  
HETATM   22  N   UNL     1       2.088   4.332  -0.291  1.00  0.00           N  
HETATM   23  C   UNL     1       2.645   5.536  -0.914  1.00  0.00           C  
HETATM   24  C   UNL     1       2.931   3.407   0.305  1.00  0.00           C  
HETATM   25  N   UNL     1       3.509   2.455  -0.421  1.00  0.00           N  
HETATM   26  C   UNL     1       4.314   1.570   0.146  1.00  0.00           C  
HETATM   27  N   UNL     1       4.574   1.598   1.444  1.00  0.00           N  
HETATM   28  C   UNL     1       4.032   2.519   2.228  1.00  0.00           C  
HETATM   29  C   UNL     1       3.190   3.464   1.676  1.00  0.00           C  
HETATM   30  N   UNL     1       4.900   0.590  -0.639  1.00  0.00           N  
HETATM   31  C   UNL     1       5.764  -0.345  -0.061  1.00  0.00           C  
HETATM   32  C   UNL     1       5.783  -1.654  -0.524  1.00  0.00           C  
HETATM   33  C   UNL     1       6.638  -2.575   0.049  1.00  0.00           C  
HETATM   34  C   UNL     1       7.475  -2.195   1.082  1.00  0.00           C  
HETATM   35  C   UNL     1       7.458  -0.891   1.546  1.00  0.00           C  
HETATM   36  C   UNL     1       6.610   0.036   0.973  1.00  0.00           C  
HETATM   37  S   UNL     1       6.663  -4.236  -0.537  1.00  0.00           S  
HETATM   38  O   UNL     1       7.166  -5.030   0.529  1.00  0.00           O  
HETATM   39  O   UNL     1       5.400  -4.465  -1.147  1.00  0.00           O  
HETATM   40  N   UNL     1       7.789  -4.312  -1.749  1.00  0.00           N  
HETATM   41  H   UNL     1      -4.978  -2.454  -1.288  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.075  -0.168  -1.407  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.527   1.301   0.644  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.433  -0.984   0.754  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.830   2.765  -0.577  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.024   4.230  -0.301  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.146   5.469  -1.504  1.00  0.00           H  
HETATM   48  H   UNL     1       0.285   5.848  -1.491  1.00  0.00           H  
HETATM   49  H   UNL     1       0.820   2.338   0.892  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.613   1.965   0.888  1.00  0.00           H  
HETATM   51  H   UNL     1       2.701   6.335  -0.175  1.00  0.00           H  
HETATM   52  H   UNL     1       3.645   5.320  -1.292  1.00  0.00           H  
HETATM   53  H   UNL     1       2.005   5.848  -1.739  1.00  0.00           H  
HETATM   54  H   UNL     1       4.249   2.533   3.285  1.00  0.00           H  
HETATM   55  H   UNL     1       2.738   4.228   2.292  1.00  0.00           H  
HETATM   56  H   UNL     1       4.711   0.553  -1.590  1.00  0.00           H  
HETATM   57  H   UNL     1       5.129  -1.952  -1.330  1.00  0.00           H  
HETATM   58  H   UNL     1       8.142  -2.917   1.529  1.00  0.00           H  
HETATM   59  H   UNL     1       8.112  -0.598   2.353  1.00  0.00           H  
HETATM   60  H   UNL     1       6.601   1.054   1.332  1.00  0.00           H  
HETATM   61  H   UNL     1       8.273  -5.137  -1.910  1.00  0.00           H  
HETATM   62  H   UNL     1       7.964  -3.532  -2.297  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    4    5                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    2    6                                                 
CONECT    6    5    7    7   11                                       
CONECT    7    6    6    8   41                                       
CONECT    8    7    9    9   42                                       
CONECT    9    8    8   10   12                                       
CONECT   10    9   11   11   43                                       
CONECT   11    6   10   10   44                                       
CONECT   12    9   13   45                                            
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   46                                            
CONECT   16   15   17   17   21                                       
CONECT   17   16   16   18   47                                       
CONECT   18   17   19   19   48                                       
CONECT   19   18   18   20   22                                       
CONECT   20   19   21   21   49                                       
CONECT   21   16   20   20   50                                       
CONECT   22   19   23   24                                            
CONECT   23   22   51   52   53                                       
CONECT   24   22   25   25   29                                       
CONECT   25   24   24   26                                            
CONECT   26   25   27   27   30                                       
CONECT   27   26   26   28                                            
CONECT   28   27   29   29   54                                       
CONECT   29   24   28   28   55                                       
CONECT   30   26   31   56                                            
CONECT   31   30   32   32   36                                       
CONECT   32   31   31   33   57                                       
CONECT   33   32   34   34   37                                       
CONECT   34   33   33   35   58                                       
CONECT   35   34   36   36   59                                       
CONECT   36   31   35   35   60                                       
CONECT   37   33   38   38   39                                       
CONECT   37   39   40                                                 
CONECT   38   37   37                                                 
CONECT   39   37   37                                                 
CONECT   40   37   61   62                                            
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   15                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   32                                                      
CONECT   58   34                                                      
CONECT   59   35                                                      
CONECT   60   36                                                      
CONECT   61   40                                                      
CONECT   62   40                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
