COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.285  -4.378   2.004  1.00  0.00           C  
HETATM    2  N   UNL     1       5.463  -2.922   1.929  1.00  0.00           N  
HETATM    3  C   UNL     1       6.270  -2.551   0.760  1.00  0.00           C  
HETATM    4  C   UNL     1       6.556  -1.048   0.792  1.00  0.00           C  
HETATM    5  C   UNL     1       5.232  -0.280   0.785  1.00  0.00           C  
HETATM    6  O   UNL     1       5.491   1.122   0.873  1.00  0.00           O  
HETATM    7  C   UNL     1       4.540   1.958   0.380  1.00  0.00           C  
HETATM    8  C   UNL     1       4.779   3.329   0.333  1.00  0.00           C  
HETATM    9  C   UNL     1       3.834   4.183  -0.159  1.00  0.00           C  
HETATM   10  C   UNL     1       2.614   3.683  -0.622  1.00  0.00           C  
HETATM   11  N   UNL     1       1.506   4.264  -1.153  1.00  0.00           N  
HETATM   12  C   UNL     1       0.622   3.352  -1.430  1.00  0.00           C  
HETATM   13  N   UNL     1       1.101   2.119  -1.094  1.00  0.00           N  
HETATM   14  C   UNL     1       0.436   0.905  -1.245  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.821   0.656  -0.827  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.278  -0.616  -1.082  1.00  0.00           C  
HETATM   17  O   UNL     1      -2.520  -1.036  -0.729  1.00  0.00           O  
HETATM   18  C   UNL     1      -3.361  -0.090  -0.066  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.689  -0.730   0.245  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.924  -2.044  -0.113  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.143  -2.632   0.172  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.126  -1.905   0.817  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.891  -0.591   1.176  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.671  -0.005   0.895  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.413   1.426   1.291  1.00  0.00           C  
HETATM   26  F   UNL     1      -4.321   1.478   2.164  1.00  0.00           F  
HETATM   27  F   UNL     1      -5.133   2.183   0.149  1.00  0.00           F  
HETATM   28  F   UNL     1      -6.545   1.945   1.929  1.00  0.00           F  
HETATM   29  C   UNL     1      -0.372  -1.424  -1.723  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.598  -2.769  -2.095  1.00  0.00           C  
HETATM   31  N   UNL     1       0.370  -3.466  -2.723  1.00  0.00           N  
HETATM   32  O   UNL     1      -1.667  -3.298  -1.849  1.00  0.00           O  
HETATM   33  S   UNL     1       1.110  -0.524  -2.016  1.00  0.00           S  
HETATM   34  C   UNL     1       2.370   2.300  -0.576  1.00  0.00           C  
HETATM   35  C   UNL     1       3.341   1.443  -0.078  1.00  0.00           C  
HETATM   36  C   UNL     1       4.390  -0.721   1.986  1.00  0.00           C  
HETATM   37  C   UNL     1       4.166  -2.233   1.919  1.00  0.00           C  
HETATM   38  H   UNL     1       6.260  -4.859   2.086  1.00  0.00           H  
HETATM   39  H   UNL     1       4.683  -4.626   2.879  1.00  0.00           H  
HETATM   40  H   UNL     1       4.780  -4.730   1.105  1.00  0.00           H  
HETATM   41  H   UNL     1       7.211  -3.100   0.779  1.00  0.00           H  
HETATM   42  H   UNL     1       5.725  -2.796  -0.152  1.00  0.00           H  
HETATM   43  H   UNL     1       7.114  -0.803   1.696  1.00  0.00           H  
HETATM   44  H   UNL     1       7.143  -0.770  -0.083  1.00  0.00           H  
HETATM   45  H   UNL     1       4.691  -0.494  -0.137  1.00  0.00           H  
HETATM   46  H   UNL     1       5.720   3.720   0.690  1.00  0.00           H  
HETATM   47  H   UNL     1       4.030   5.245  -0.190  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.350   3.542  -1.861  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.424   1.400  -0.329  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.886   0.231   0.861  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.517   0.774  -0.713  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.156  -2.612  -0.617  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.326  -3.658  -0.109  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.078  -2.364   1.040  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.659  -0.023   1.679  1.00  0.00           H  
HETATM   56  H   UNL     1       1.221  -3.045  -2.919  1.00  0.00           H  
HETATM   57  H   UNL     1       0.215  -4.389  -2.979  1.00  0.00           H  
HETATM   58  H   UNL     1       3.159   0.379  -0.044  1.00  0.00           H  
HETATM   59  H   UNL     1       4.913  -0.471   2.909  1.00  0.00           H  
HETATM   60  H   UNL     1       3.428  -0.209   1.963  1.00  0.00           H  
HETATM   61  H   UNL     1       3.630  -2.481   1.002  1.00  0.00           H  
HETATM   62  H   UNL     1       3.579  -2.552   2.780  1.00  0.00           H  
CONECT    1    2   38   39   40                                       
CONECT    2    1   37    3                                            
CONECT    3    2    4   41   42                                       
CONECT    4    3    5   43   44                                       
CONECT    5    4    6   36   45                                       
CONECT    6    5    7                                                 
CONECT    7    6   35   35    8                                       
CONECT    8    7    9    9   46                                       
CONECT    9    8    8   10   47                                       
CONECT   10    9   34   34   11                                       
CONECT   11   10   12   12                                            
CONECT   12   11   11   13   48                                       
CONECT   13   12   14   34                                            
CONECT   14   13   15   15   33                                       
CONECT   15   14   14   16   49                                       
CONECT   16   15   17   29   29                                       
CONECT   17   16   18                                                 
CONECT   18   17   19   50   51                                       
CONECT   19   18   20   20   24                                       
CONECT   20   19   19   21   52                                       
CONECT   21   20   22   22   53                                       
CONECT   22   21   21   23   54                                       
CONECT   23   22   24   24   55                                       
CONECT   24   19   23   23   25                                       
CONECT   25   24   27   28   26                                       
CONECT   26   25                                                      
CONECT   27   25                                                      
CONECT   28   25                                                      
CONECT   29   16   16   30   33                                       
CONECT   30   29   31   32   32                                       
CONECT   31   30   56   57                                            
CONECT   32   30   30                                                 
CONECT   33   14   29                                                 
CONECT   34   10   10   13   35                                       
CONECT   35    7    7   34   58                                       
CONECT   36    5   37   59   60                                       
CONECT   37    2   36   61   62                                       
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48   12                                                      
CONECT   49   15                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   35                                                      
CONECT   59   36                                                      
CONECT   60   36                                                      
CONECT   61   37                                                      
CONECT   62   37                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
