COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.362   7.537   0.178  1.00  0.00           C  
HETATM    2  C   UNL     1       4.134   6.627   0.110  1.00  0.00           C  
HETATM    3  C   UNL     1       4.585   5.167   0.029  1.00  0.00           C  
HETATM    4  C   UNL     1       3.358   4.256  -0.039  1.00  0.00           C  
HETATM    5  N   UNL     1       3.790   2.859  -0.117  1.00  0.00           N  
HETATM    6  C   UNL     1       2.852   1.850  -0.187  1.00  0.00           C  
HETATM    7  N   UNL     1       1.563   2.168  -0.183  1.00  0.00           N  
HETATM    8  C   UNL     1       0.630   1.237  -0.249  1.00  0.00           C  
HETATM    9  C   UNL     1       1.013  -0.106  -0.325  1.00  0.00           C  
HETATM   10  C   UNL     1       0.007  -1.177  -0.401  1.00  0.00           C  
HETATM   11  O   UNL     1       0.356  -2.330  -0.569  1.00  0.00           O  
HETATM   12  N   UNL     1      -1.303  -0.881  -0.283  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.305  -1.947  -0.359  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.682  -1.354  -0.200  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.385  -0.931  -1.312  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.647  -0.388  -1.167  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.207  -0.268   0.091  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.504  -0.692   1.204  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.244  -1.239   1.058  1.00  0.00           C  
HETATM   20  S   UNL     1      -7.816   0.426   0.277  1.00  0.00           S  
HETATM   21  O   UNL     1      -7.889   0.920   1.607  1.00  0.00           O  
HETATM   22  O   UNL     1      -8.038   1.238  -0.867  1.00  0.00           O  
HETATM   23  N   UNL     1      -8.902  -0.821   0.183  1.00  0.00           N  
HETATM   24  C   UNL     1       2.393  -0.406  -0.327  1.00  0.00           C  
HETATM   25  N   UNL     1       2.827  -1.713  -0.400  1.00  0.00           N  
HETATM   26  C   UNL     1       4.255  -2.017  -0.282  1.00  0.00           C  
HETATM   27  C   UNL     1       4.554  -3.343  -0.985  1.00  0.00           C  
HETATM   28  C   UNL     1       6.045  -3.662  -0.863  1.00  0.00           C  
HETATM   29  C   UNL     1       6.423  -3.773   0.616  1.00  0.00           C  
HETATM   30  O   UNL     1       7.816  -4.070   0.731  1.00  0.00           O  
HETATM   31  C   UNL     1       6.125  -2.447   1.319  1.00  0.00           C  
HETATM   32  C   UNL     1       4.633  -2.129   1.197  1.00  0.00           C  
HETATM   33  N   UNL     1       3.265   0.593  -0.262  1.00  0.00           N  
HETATM   34  H   UNL     1       5.041   8.577   0.236  1.00  0.00           H  
HETATM   35  H   UNL     1       5.950   7.289   1.061  1.00  0.00           H  
HETATM   36  H   UNL     1       5.970   7.394  -0.715  1.00  0.00           H  
HETATM   37  H   UNL     1       3.526   6.770   1.003  1.00  0.00           H  
HETATM   38  H   UNL     1       3.546   6.875  -0.774  1.00  0.00           H  
HETATM   39  H   UNL     1       5.194   5.024  -0.864  1.00  0.00           H  
HETATM   40  H   UNL     1       5.173   4.919   0.912  1.00  0.00           H  
HETATM   41  H   UNL     1       2.749   4.400   0.854  1.00  0.00           H  
HETATM   42  H   UNL     1       2.770   4.505  -0.923  1.00  0.00           H  
HETATM   43  H   UNL     1       4.735   2.643  -0.119  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.416   1.508  -0.245  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.582   0.039  -0.149  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.233  -2.445  -1.326  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.127  -2.670   0.437  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.947  -1.025  -2.296  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.196  -0.057  -2.036  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.942  -0.598   2.187  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.696  -1.574   1.926  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.742  -0.770   0.664  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.697  -1.603  -0.354  1.00  0.00           H  
HETATM   54  H   UNL     1       2.187  -2.430  -0.529  1.00  0.00           H  
HETATM   55  H   UNL     1       4.837  -1.221  -0.747  1.00  0.00           H  
HETATM   56  H   UNL     1       3.973  -4.140  -0.521  1.00  0.00           H  
HETATM   57  H   UNL     1       4.285  -3.264  -2.039  1.00  0.00           H  
HETATM   58  H   UNL     1       6.257  -4.606  -1.364  1.00  0.00           H  
HETATM   59  H   UNL     1       6.626  -2.865  -1.327  1.00  0.00           H  
HETATM   60  H   UNL     1       5.842  -4.569   1.081  1.00  0.00           H  
HETATM   61  H   UNL     1       8.126  -4.155   1.643  1.00  0.00           H  
HETATM   62  H   UNL     1       6.394  -2.526   2.373  1.00  0.00           H  
HETATM   63  H   UNL     1       6.706  -1.651   0.855  1.00  0.00           H  
HETATM   64  H   UNL     1       4.421  -1.184   1.698  1.00  0.00           H  
HETATM   65  H   UNL     1       4.052  -2.925   1.661  1.00  0.00           H  
CONECT    1    2   34   35   36                                       
CONECT    2    1    3   37   38                                       
CONECT    3    2    4   39   40                                       
CONECT    4    3    5   41   42                                       
CONECT    5    4    6   43                                            
CONECT    6    5    7    7   33                                       
CONECT    7    6    6    8                                            
CONECT    8    7    9    9   44                                       
CONECT    9    8    8   10   24                                       
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   45                                            
CONECT   13   12   14   46   47                                       
CONECT   14   13   15   15   19                                       
CONECT   15   14   14   16   48                                       
CONECT   16   15   17   17   49                                       
CONECT   17   16   16   18   20                                       
CONECT   18   17   19   19   50                                       
CONECT   19   14   18   18   51                                       
CONECT   20   17   21   21   22                                       
CONECT   20   22   23                                                 
CONECT   21   20   20                                                 
CONECT   22   20   20                                                 
CONECT   23   20   52   53                                            
CONECT   24    9   25   33   33                                       
CONECT   25   24   26   54                                            
CONECT   26   25   27   32   55                                       
CONECT   27   26   28   56   57                                       
CONECT   28   27   29   58   59                                       
CONECT   29   28   30   31   60                                       
CONECT   30   29   61                                                 
CONECT   31   29   32   62   63                                       
CONECT   32   26   31   64   65                                       
CONECT   33    6   24   24                                            
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    8                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
