COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.991   0.013   0.180  1.00  0.00           C  
HETATM    2  C   UNL     1       5.197   0.879   0.908  1.00  0.00           C  
HETATM    3  C   UNL     1       3.845   0.629   1.045  1.00  0.00           C  
HETATM    4  C   UNL     1       3.286  -0.488   0.453  1.00  0.00           C  
HETATM    5  C   UNL     1       5.432  -1.105  -0.411  1.00  0.00           C  
HETATM    6  C   UNL     1       1.049  -0.091  -0.541  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.382  -0.133   1.011  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.198   0.285  -0.215  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.591  -0.359  -1.465  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.126   0.065  -1.592  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.859  -1.480   0.036  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.291  -1.947   0.102  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.324  -3.469   0.257  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.620   0.774  -0.003  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.944   1.519  -1.129  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.964   2.448  -1.071  1.00  0.00           C  
HETATM   17  N   UNL     1       7.899   1.266  -1.357  1.00  0.00           N  
HETATM   18  C   UNL     1       4.079  -1.355  -0.275  1.00  0.00           C  
HETATM   19  S   UNL     1       7.714   0.336   0.001  1.00  0.00           S  
HETATM   20  O   UNL     1       8.085   1.155   1.101  1.00  0.00           O  
HETATM   21  O   UNL     1       8.329  -0.913  -0.282  1.00  0.00           O  
HETATM   22  C   UNL     1       1.811  -0.762   0.603  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.388  -0.358  -0.395  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.923   0.284   0.813  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.583  -0.164  -0.057  1.00  0.00           N  
HETATM   26  O   UNL     1      -3.955  -2.288   0.068  1.00  0.00           O  
HETATM   27  C   UNL     1      -7.663   2.636   0.107  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.344   1.896   1.230  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.325   0.965   1.178  1.00  0.00           C  
HETATM   30  H   UNL     1       5.634   1.752   1.371  1.00  0.00           H  
HETATM   31  H   UNL     1       3.225   1.306   1.614  1.00  0.00           H  
HETATM   32  H   UNL     1       6.051  -1.779  -0.984  1.00  0.00           H  
HETATM   33  H   UNL     1       1.224   0.985  -0.511  1.00  0.00           H  
HETATM   34  H   UNL     1       1.398  -0.489  -1.493  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.783   0.356   1.899  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.437  -1.214   1.135  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.174   1.370  -0.316  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.650  -1.444  -1.381  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.142  -0.031  -2.347  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.687  -0.403  -2.473  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.069   1.149  -1.690  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.785  -1.484   0.955  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.807  -1.664  -0.816  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.829  -3.932  -0.597  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.807  -3.752   1.174  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.359  -3.806   0.304  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.398   1.373  -2.049  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.216   3.029  -1.946  1.00  0.00           H  
HETATM   49  H   UNL     1       7.122   1.523  -1.879  1.00  0.00           H  
HETATM   50  H   UNL     1       8.784   1.553  -1.631  1.00  0.00           H  
HETATM   51  H   UNL     1       3.642  -2.228  -0.737  1.00  0.00           H  
HETATM   52  H   UNL     1       1.637  -1.838   0.574  1.00  0.00           H  
HETATM   53  H   UNL     1       1.463  -0.364   1.556  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.866   1.367   0.704  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.336  -0.024   1.678  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.461   3.364   0.150  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.892   2.045   2.149  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.076   0.387   2.056  1.00  0.00           H  
CONECT    1    2    2    5   19                                       
CONECT    2    3    1    1   30                                       
CONECT    3    4    4    2   31                                       
CONECT    4   22    3    3   18                                       
CONECT    5   18   18    1   32                                       
CONECT    6   23   22   33   34                                       
CONECT    7    8   24   35   36                                       
CONECT    8   25    7    9   37                                       
CONECT    9    8   10   38   39                                       
CONECT   10    9   23   40   41                                       
CONECT   11   26   26   12   25                                       
CONECT   12   13   11   42   43                                       
CONECT   13   12   44   45   46                                       
CONECT   14   25   15   15   29                                       
CONECT   15   14   14   16   47                                       
CONECT   16   15   27   27   48                                       
CONECT   17   19   49   50                                            
CONECT   18    4    5    5   51                                       
CONECT   19    1   21   21   20                                       
CONECT   19   20   17                                                 
CONECT   20   19   19                                                 
CONECT   21   19   19                                                 
CONECT   22    6    4   52   53                                       
CONECT   23   24   10    6                                            
CONECT   24    7   23   54   55                                       
CONECT   25   11    8   14                                            
CONECT   26   11   11                                                 
CONECT   27   16   16   28   56                                       
CONECT   28   29   29   27   57                                       
CONECT   29   14   28   28   58                                       
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
