COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.331  -3.210  -0.332  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.866  -0.971  -0.398  1.00  0.00           C  
HETATM    3  C   UNL     1       2.439  -2.572  -0.276  1.00  0.00           C  
HETATM    4  C   UNL     1       2.175  -0.022  -0.330  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.324   2.290   0.491  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.793  -4.044  -0.354  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.076   1.506   0.554  1.00  0.00           C  
HETATM    8  C   UNL     1       4.145   3.429  -0.083  1.00  0.00           C  
HETATM    9  C   UNL     1       6.045   4.101  -1.174  1.00  0.00           C  
HETATM   10  C   UNL     1       4.797   4.405  -0.816  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.944   0.472   1.486  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.660   5.099  -1.491  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.704   4.015  -0.413  1.00  0.00           C  
HETATM   14  O   UNL     1      -6.449   3.286  -0.407  1.00  0.00           O  
HETATM   15  O   UNL     1      -7.239   2.037   1.250  1.00  0.00           O  
HETATM   16  C   UNL     1      -3.779  -0.258   1.542  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.732   0.033   0.672  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.554  -0.708   0.731  1.00  0.00           N  
HETATM   19  O   UNL     1      -1.226  -0.490  -1.456  1.00  0.00           O  
HETATM   20  C   UNL     1       0.321  -1.838  -0.351  1.00  0.00           C  
HETATM   21  C   UNL     1       1.631  -1.430  -0.318  1.00  0.00           C  
HETATM   22  N   UNL     1       3.613  -0.111  -0.017  1.00  0.00           N  
HETATM   23  C   UNL     1       4.416  -1.143  -0.687  1.00  0.00           C  
HETATM   24  C   UNL     1       3.948  -2.531  -0.231  1.00  0.00           C  
HETATM   25  N   UNL     1       1.669  -3.626  -0.280  1.00  0.00           N  
HETATM   26  C   UNL     1      -1.842  -3.776  -1.224  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.949  -4.601  -1.244  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.014  -5.693  -0.399  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.972  -5.963   0.469  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.859  -5.145   0.489  1.00  0.00           C  
HETATM   31  S   UNL     1       4.309   0.930   1.067  1.00  0.00           S  
HETATM   32  O   UNL     1       3.262   1.389   1.911  1.00  0.00           O  
HETATM   33  O   UNL     1       5.474   0.280   1.557  1.00  0.00           O  
HETATM   34  C   UNL     1       4.866   2.333   0.159  1.00  0.00           C  
HETATM   35  S   UNL     1       6.459   2.502  -0.568  1.00  0.00           S  
HETATM   36  C   UNL     1      -2.859   1.061  -0.257  1.00  0.00           C  
HETATM   37  C   UNL     1      -4.024   1.792  -0.322  1.00  0.00           C  
HETATM   38  H   UNL     1       2.037   0.421  -1.317  1.00  0.00           H  
HETATM   39  H   UNL     1       1.666   0.580   0.422  1.00  0.00           H  
HETATM   40  H   UNL     1       3.132   3.547   0.270  1.00  0.00           H  
HETATM   41  H   UNL     1       6.702   4.739  -1.746  1.00  0.00           H  
HETATM   42  H   UNL     1       4.330   5.343  -1.079  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.756   0.246   2.161  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.603   5.646  -1.495  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.841   5.787  -1.282  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.505   4.636  -2.466  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.860   4.478   0.562  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.523   3.327  -0.622  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.676  -1.057   2.261  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.228  -1.035   1.584  1.00  0.00           H  
HETATM   51  H   UNL     1       4.293  -1.055  -1.766  1.00  0.00           H  
HETATM   52  H   UNL     1       5.467  -1.012  -0.429  1.00  0.00           H  
HETATM   53  H   UNL     1       4.288  -2.715   0.788  1.00  0.00           H  
HETATM   54  H   UNL     1       4.354  -3.291  -0.898  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.792  -2.922  -1.884  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.765  -4.392  -1.920  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.881  -6.337  -0.416  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.026  -6.817   1.128  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.043  -5.359   1.164  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.045   1.285  -0.930  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.123   2.590  -1.043  1.00  0.00           H  
CONECT    1   25   20    6                                            
CONECT    2   20   19   19   18                                       
CONECT    3   24   21   25   25                                       
CONECT    4   22   21   38   39                                       
CONECT    5    7   15   15   14                                       
CONECT    6    1   30   30   26                                       
CONECT    7   37   37   11    5                                       
CONECT    8   10   34   34   40                                       
CONECT    9   35   10   10   41                                       
CONECT   10    9    9    8   42                                       
CONECT   11   16   16    7   43                                       
CONECT   12   13   44   45   46                                       
CONECT   13   14   12   47   48                                       
CONECT   14    5   13                                                 
CONECT   15    5    5                                                 
CONECT   16   17   11   11   49                                       
CONECT   17   18   36   36   16                                       
CONECT   18    2   17   50                                            
CONECT   19    2    2                                                 
CONECT   20   21   21    2    1                                       
CONECT   21    4    3   20   20                                       
CONECT   22   31   23    4                                            
CONECT   23   22   24   51   52                                       
CONECT   24   23    3   53   54                                       
CONECT   25    3    3    1                                            
CONECT   26    6   27   27   55                                       
CONECT   27   26   26   28   56                                       
CONECT   28   29   29   27   57                                       
CONECT   29   30   28   28   58                                       
CONECT   30    6    6   29   59                                       
CONECT   31   33   33   34   32                                       
CONECT   31   32   22                                                 
CONECT   32   31   31                                                 
CONECT   33   31   31                                                 
CONECT   34   35   31    8    8                                       
CONECT   35    9   34                                                 
CONECT   36   17   17   37   60                                       
CONECT   37   36    7    7   61                                       
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   16                                                      
CONECT   50   18                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   36                                                      
CONECT   61   37                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
