COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.400   2.585  -0.118  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.505   1.676  -0.650  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.332   2.173   0.816  1.00  0.00           C  
HETATM    4  C   UNL     1       0.447   0.581   1.431  1.00  0.00           C  
HETATM    5  C   UNL     1       2.956  -0.320   0.181  1.00  0.00           C  
HETATM    6  C   UNL     1       2.016  -1.319   0.864  1.00  0.00           C  
HETATM    7  C   UNL     1       4.453  -2.181  -0.215  1.00  0.00           C  
HETATM    8  C   UNL     1       8.688  -0.221   0.652  1.00  0.00           C  
HETATM    9  N   UNL     1       0.657  -0.761   0.871  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.378  -1.467   0.374  1.00  0.00           C  
HETATM   11  C   UNL     1       3.194   0.892   2.356  1.00  0.00           C  
HETATM   12  C   UNL     1       2.839   1.042   0.876  1.00  0.00           C  
HETATM   13  C   UNL     1       1.405   1.561   0.745  1.00  0.00           C  
HETATM   14  N   UNL     1       4.340  -0.803   0.280  1.00  0.00           N  
HETATM   15  C   UNL     1       5.208   0.039  -0.392  1.00  0.00           C  
HETATM   16  C   UNL     1       6.579   0.043  -0.096  1.00  0.00           C  
HETATM   17  C   UNL     1       7.440  -0.683   0.836  1.00  0.00           C  
HETATM   18  N   UNL     1       8.687   0.745  -0.320  1.00  0.00           N  
HETATM   19  C   UNL     1       7.418   0.932  -0.794  1.00  0.00           C  
HETATM   20  N   UNL     1       6.876   1.727  -1.715  1.00  0.00           N  
HETATM   21  C   UNL     1       5.585   1.685  -1.964  1.00  0.00           C  
HETATM   22  N   UNL     1       4.762   0.870  -1.329  1.00  0.00           N  
HETATM   23  O   UNL     1      -0.225  -2.631   0.061  1.00  0.00           O  
HETATM   24  N   UNL     1      -1.582  -0.881   0.222  1.00  0.00           N  
HETATM   25  C   UNL     1      -1.937   0.476   0.664  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.420   0.702   0.304  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.974  -0.743   0.190  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.760  -1.492  -0.419  1.00  0.00           C  
HETATM   29  S   UNL     1      -5.402  -0.806  -0.927  1.00  0.00           S  
HETATM   30  O   UNL     1      -5.066  -0.264  -2.197  1.00  0.00           O  
HETATM   31  O   UNL     1      -6.067  -2.057  -0.817  1.00  0.00           O  
HETATM   32  C   UNL     1      -6.542   0.354  -0.248  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.474  -0.059   0.686  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.373   0.849   1.213  1.00  0.00           C  
HETATM   35  H   UNL     1      -7.368   3.619  -0.429  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.777   1.998  -1.380  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.028   2.884   1.235  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.582   0.894   1.256  1.00  0.00           H  
HETATM   39  H   UNL     1       0.647   0.565   2.503  1.00  0.00           H  
HETATM   40  H   UNL     1       2.679  -0.220  -0.868  1.00  0.00           H  
HETATM   41  H   UNL     1       2.021  -2.260   0.315  1.00  0.00           H  
HETATM   42  H   UNL     1       2.347  -1.490   1.889  1.00  0.00           H  
HETATM   43  H   UNL     1       4.039  -2.241  -1.221  1.00  0.00           H  
HETATM   44  H   UNL     1       5.503  -2.474  -0.237  1.00  0.00           H  
HETATM   45  H   UNL     1       3.903  -2.851   0.445  1.00  0.00           H  
HETATM   46  H   UNL     1       9.561  -0.557   1.193  1.00  0.00           H  
HETATM   47  H   UNL     1       4.231   0.567   2.450  1.00  0.00           H  
HETATM   48  H   UNL     1       3.067   1.850   2.859  1.00  0.00           H  
HETATM   49  H   UNL     1       2.539   0.151   2.814  1.00  0.00           H  
HETATM   50  H   UNL     1       3.524   1.748   0.407  1.00  0.00           H  
HETATM   51  H   UNL     1       1.144   1.646  -0.310  1.00  0.00           H  
HETATM   52  H   UNL     1       1.327   2.539   1.220  1.00  0.00           H  
HETATM   53  H   UNL     1       7.132  -1.444   1.537  1.00  0.00           H  
HETATM   54  H   UNL     1       9.472   1.226  -0.627  1.00  0.00           H  
HETATM   55  H   UNL     1       5.181   2.345  -2.718  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.800   0.562   1.742  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.315   1.208   0.150  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.931   1.249   1.097  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.511   1.226  -0.647  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.231  -1.142   1.172  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.723  -1.345  -1.499  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.812  -2.555  -0.183  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.503  -1.092   1.000  1.00  0.00           H  
HETATM   64  H   UNL     1      -9.101   0.527   1.943  1.00  0.00           H  
CONECT    1    2    3    3   35                                       
CONECT    2   32   32    1   36                                       
CONECT    3    1    1   34   37                                       
CONECT    4    9   13   38   39                                       
CONECT    5   14    6   12   40                                       
CONECT    6    5    9   41   42                                       
CONECT    7   14   43   44   45                                       
CONECT    8   18   17   17   46                                       
CONECT    9    6   10    4                                            
CONECT   10    9   23   23   24                                       
CONECT   11   12   47   48   49                                       
CONECT   12    5   11   13   50                                       
CONECT   13   12    4   51   52                                       
CONECT   14   15    7    5                                            
CONECT   15   22   22   16   14                                       
CONECT   16   19   19   15   17                                       
CONECT   17   16    8    8   53                                       
CONECT   18   19    8   54                                            
CONECT   19   20   18   16   16                                       
CONECT   20   21   21   19                                            
CONECT   21   20   20   22   55                                       
CONECT   22   21   15   15                                            
CONECT   23   10   10                                                 
CONECT   24   10   25   28                                            
CONECT   25   24   26   56   57                                       
CONECT   26   25   27   58   59                                       
CONECT   27   29   26   28   60                                       
CONECT   28   24   27   61   62                                       
CONECT   29   30   30   31   31                                       
CONECT   29   27   32                                                 
CONECT   30   29   29                                                 
CONECT   31   29   29                                                 
CONECT   32   29    2    2   33                                       
CONECT   33   32   34   34   63                                       
CONECT   34   33   33    3   64                                       
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   21                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   28                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
