COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.977  -2.386  -0.597  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.459  -1.075  -0.412  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.820  -1.172  -0.141  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.667   0.169  -0.490  1.00  0.00           C  
HETATM    5  N   UNL     1      -3.136  -2.497  -0.164  1.00  0.00           N  
HETATM    6  N   UNL     1      -1.972  -3.218  -0.449  1.00  0.00           N  
HETATM    7  C   UNL     1       1.146   1.438  -0.774  1.00  0.00           C  
HETATM    8  C   UNL     1       0.314   2.455  -0.539  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.465  -3.067   0.068  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.453  -2.491  -0.948  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.402  -4.588  -0.088  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.746  -0.052   0.122  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.368   0.607  -0.942  1.00  0.00           C  
HETATM   14  O   UNL     1       2.885   0.158   0.748  1.00  0.00           O  
HETATM   15  C   UNL     1       3.434   0.841  -0.090  1.00  0.00           C  
HETATM   16  N   UNL     1       4.780   0.876  -0.155  1.00  0.00           N  
HETATM   17  C   UNL     1       5.579   0.089   0.786  1.00  0.00           C  
HETATM   18  C   UNL     1       7.066   0.306   0.498  1.00  0.00           C  
HETATM   19  C   UNL     1       7.904  -0.417   1.558  1.00  0.00           C  
HETATM   20  C   UNL     1       9.389  -0.260   1.217  1.00  0.00           C  
HETATM   21  O   UNL     1       9.633  -0.780  -0.092  1.00  0.00           O  
HETATM   22  C   UNL     1       8.912  -0.112  -1.129  1.00  0.00           C  
HETATM   23  C   UNL     1       7.409  -0.262  -0.883  1.00  0.00           C  
HETATM   24  C   UNL     1       2.611   1.651  -1.058  1.00  0.00           C  
HETATM   25  N   UNL     1       0.609   0.238  -0.745  1.00  0.00           N  
HETATM   26  S   UNL     1      -1.297   1.798  -0.261  1.00  0.00           S  
HETATM   27  C   UNL     1      -4.929  -2.719   1.484  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.006   0.348   1.434  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.875   1.391   1.675  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.491   2.043   0.615  1.00  0.00           C  
HETATM   31  O   UNL     1      -6.346   3.070   0.857  1.00  0.00           O  
HETATM   32  C   UNL     1      -6.946   3.697  -0.279  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.231   1.652  -0.692  1.00  0.00           C  
HETATM   34  H   UNL     1       0.043  -2.656  -0.826  1.00  0.00           H  
HETATM   35  H   UNL     1       0.582   3.501  -0.524  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.177  -2.820  -1.950  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.459  -2.839  -0.715  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.426  -1.402  -0.904  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.699  -4.999   0.636  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.391  -5.012   0.085  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.072  -4.836  -1.096  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.172   0.298  -1.958  1.00  0.00           H  
HETATM   43  H   UNL     1       5.219   1.423  -0.826  1.00  0.00           H  
HETATM   44  H   UNL     1       5.357   0.405   1.805  1.00  0.00           H  
HETATM   45  H   UNL     1       5.338  -0.968   0.673  1.00  0.00           H  
HETATM   46  H   UNL     1       7.290   1.372   0.521  1.00  0.00           H  
HETATM   47  H   UNL     1       7.707   0.019   2.537  1.00  0.00           H  
HETATM   48  H   UNL     1       7.643  -1.475   1.569  1.00  0.00           H  
HETATM   49  H   UNL     1       9.658   0.795   1.245  1.00  0.00           H  
HETATM   50  H   UNL     1       9.988  -0.808   1.944  1.00  0.00           H  
HETATM   51  H   UNL     1       9.176   0.946  -1.132  1.00  0.00           H  
HETATM   52  H   UNL     1       9.169  -0.553  -2.092  1.00  0.00           H  
HETATM   53  H   UNL     1       7.137  -1.317  -0.920  1.00  0.00           H  
HETATM   54  H   UNL     1       6.858   0.284  -1.648  1.00  0.00           H  
HETATM   55  H   UNL     1       2.834   1.335  -2.077  1.00  0.00           H  
HETATM   56  H   UNL     1       2.853   2.708  -0.945  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.078  -1.642   1.563  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.868  -3.231   1.696  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.173  -3.035   2.202  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.527  -0.158   2.259  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.080   1.698   2.690  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.605   4.498   0.054  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.167   4.109  -0.919  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.523   2.960  -0.837  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.712   2.161  -1.513  1.00  0.00           H  
CONECT    1    2    6    6   34                                       
CONECT    2    4    3    3    1                                       
CONECT    3    2    2   12    5                                       
CONECT    4   26   25   25    2                                       
CONECT    5    3    6    9                                            
CONECT    6    1    1    5                                            
CONECT    7   24    8    8   25                                       
CONECT    8    7    7   26   35                                       
CONECT    9    5   11   10   27                                       
CONECT   10    9   36   37   38                                       
CONECT   11    9   39   40   41                                       
CONECT   12   28   28   13    3                                       
CONECT   13   33   33   12   42                                       
CONECT   14   15   15                                                 
CONECT   15   14   14   16   24                                       
CONECT   16   17   15   43                                            
CONECT   17   18   16   44   45                                       
CONECT   18   23   17   19   46                                       
CONECT   19   18   20   47   48                                       
CONECT   20   21   19   49   50                                       
CONECT   21   22   20                                                 
CONECT   22   23   21   51   52                                       
CONECT   23   22   18   53   54                                       
CONECT   24   15    7   55   56                                       
CONECT   25    7    4    4                                            
CONECT   26    8    4                                                 
CONECT   27    9   57   58   59                                       
CONECT   28   29   12   12   60                                       
CONECT   29   30   30   28   61                                       
CONECT   30   31   29   29   33                                       
CONECT   31   32   30                                                 
CONECT   32   31   62   63   64                                       
CONECT   33   30   13   13   65                                       
CONECT   34    1                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   13                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   27                                                      
CONECT   58   27                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   29                                                      
CONECT   62   32                                                      
CONECT   63   32                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
