COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  O   UNL     1     -10.286  -3.106   1.248  1.00  0.00           O  
HETATM    2  C   UNL     1     -10.402  -2.646   0.132  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.217  -1.601   0.398  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.272  -0.715  -0.416  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.013  -0.424   0.403  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.068   0.462  -0.410  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.944   1.514  -0.227  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.138   2.003  -1.511  1.00  0.00           C  
HETATM    9  N   UNL     1      -9.422  -1.880  -0.387  1.00  0.00           N  
HETATM   10  O   UNL     1      -3.893   0.734   0.355  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.778   1.818   0.459  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.170   2.791  -2.102  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.008   3.092  -1.416  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.812   2.606  -0.137  1.00  0.00           C  
HETATM   15  C   UNL     1       0.455   2.937   0.608  1.00  0.00           C  
HETATM   16  N   UNL     1       1.467   1.915   0.329  1.00  0.00           N  
HETATM   17  C   UNL     1       2.688   2.004   0.891  1.00  0.00           C  
HETATM   18  O   UNL     1       2.951   2.933   1.630  1.00  0.00           O  
HETATM   19  C   UNL     1       3.709   0.972   0.609  1.00  0.00           C  
HETATM   20  C   UNL     1       3.413  -0.093  -0.243  1.00  0.00           C  
HETATM   21  C   UNL     1       4.370  -1.052  -0.503  1.00  0.00           C  
HETATM   22  C   UNL     1       5.621  -0.960   0.081  1.00  0.00           C  
HETATM   23  S   UNL     1       6.838  -2.190  -0.255  1.00  0.00           S  
HETATM   24  O   UNL     1       7.746  -2.165   0.837  1.00  0.00           O  
HETATM   25  O   UNL     1       6.130  -3.356  -0.651  1.00  0.00           O  
HETATM   26  N   UNL     1       7.690  -1.686  -1.583  1.00  0.00           N  
HETATM   27  C   UNL     1       5.922   0.093   0.926  1.00  0.00           C  
HETATM   28  C   UNL     1       4.975   1.062   1.190  1.00  0.00           C  
HETATM   29  H   UNL     1     -11.289  -2.855  -0.449  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.717  -2.539   0.641  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.494  -1.087   1.319  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.996  -1.228  -1.337  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.772   0.223  -0.659  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.290   0.090   1.324  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.513  -1.361   0.646  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.792  -0.051  -1.331  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.569   1.400  -0.654  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.045   1.767  -2.047  1.00  0.00           H  
HETATM   39  H   UNL     1      -9.515  -1.512  -1.280  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.624   1.439   1.459  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.320   3.171  -3.102  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.252   3.708  -1.880  1.00  0.00           H  
HETATM   43  H   UNL     1       0.824   3.910   0.285  1.00  0.00           H  
HETATM   44  H   UNL     1       0.251   2.963   1.679  1.00  0.00           H  
HETATM   45  H   UNL     1       1.257   1.173  -0.261  1.00  0.00           H  
HETATM   46  H   UNL     1       2.436  -0.165  -0.699  1.00  0.00           H  
HETATM   47  H   UNL     1       4.142  -1.876  -1.162  1.00  0.00           H  
HETATM   48  H   UNL     1       7.466  -0.846  -2.013  1.00  0.00           H  
HETATM   49  H   UNL     1       8.413  -2.232  -1.931  1.00  0.00           H  
HETATM   50  H   UNL     1       6.900   0.159   1.378  1.00  0.00           H  
HETATM   51  H   UNL     1       5.212   1.885   1.847  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    9   29                                       
CONECT    3    9    4   30   31                                       
CONECT    4    3    5   32   33                                       
CONECT    5    4    6   34   35                                       
CONECT    6    5   10   36   37                                       
CONECT    7   10   11   11    8                                       
CONECT    8    7   12   12   38                                       
CONECT    9    2    3   39                                            
CONECT   10    6    7                                                 
CONECT   11    7    7   14   40                                       
CONECT   12    8    8   13   41                                       
CONECT   13   14   14   12   42                                       
CONECT   14   11   15   13   13                                       
CONECT   15   16   14   43   44                                       
CONECT   16   15   17   45                                            
CONECT   17   16   19   18   18                                       
CONECT   18   17   17                                                 
CONECT   19   20   17   28   28                                       
CONECT   20   21   21   19   46                                       
CONECT   21   20   20   22   47                                       
CONECT   22   21   23   27   27                                       
CONECT   23   26   25   25   22                                       
CONECT   23   24   24                                                 
CONECT   24   23   23                                                 
CONECT   25   23   23                                                 
CONECT   26   23   48   49                                            
CONECT   27   22   22   28   50                                       
CONECT   28   19   19   27   51                                       
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
