COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -6.623   0.377  -0.515  1.00  0.00           N  
HETATM    2  N   UNL     1       0.551  -3.264   0.865  1.00  0.00           N  
HETATM    3  C   UNL     1      -4.555  -0.320  -0.327  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.367  -1.130   0.026  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.086  -0.825  -0.299  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.249  -1.890   0.244  1.00  0.00           C  
HETATM    7  C   UNL     1       0.129  -2.161   0.253  1.00  0.00           C  
HETATM    8  C   UNL     1       3.243  -0.326  -0.487  1.00  0.00           C  
HETATM    9  C   UNL     1       4.716   2.020  -0.770  1.00  0.00           C  
HETATM   10  C   UNL     1       4.394  -0.126   0.246  1.00  0.00           C  
HETATM   11  C   UNL     1       6.320   3.749   0.141  1.00  0.00           C  
HETATM   12  C   UNL     1       2.554  -1.833  -2.825  1.00  0.00           C  
HETATM   13  C   UNL     1       4.268  -2.961  -1.400  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.301  -4.085   1.451  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.553   0.890  -1.051  1.00  0.00           C  
HETATM   16  O   UNL     1       7.318   0.059   0.885  1.00  0.00           O  
HETATM   17  S   UNL     1       6.564   1.241   1.115  1.00  0.00           S  
HETATM   18  O   UNL     1       6.055   1.548   2.406  1.00  0.00           O  
HETATM   19  C   UNL     1       7.399   2.685   0.393  1.00  0.00           C  
HETATM   20  C   UNL     1       5.446   3.306  -1.018  1.00  0.00           C  
HETATM   21  C   UNL     1       3.548   1.815  -1.503  1.00  0.00           C  
HETATM   22  C   UNL     1       2.818   0.655  -1.364  1.00  0.00           C  
HETATM   23  C   UNL     1       5.124   1.045   0.112  1.00  0.00           C  
HETATM   24  C   UNL     1       2.458  -1.604  -0.339  1.00  0.00           C  
HETATM   25  C   UNL     1       2.798  -2.548  -1.494  1.00  0.00           C  
HETATM   26  N   UNL     1       1.025  -1.303  -0.359  1.00  0.00           N  
HETATM   27  N   UNL     1      -1.599  -3.871   1.468  1.00  0.00           N  
HETATM   28  C   UNL     1      -2.119  -2.794   0.882  1.00  0.00           C  
HETATM   29  N   UNL     1      -3.392  -2.311   0.735  1.00  0.00           N  
HETATM   30  C   UNL     1      -5.852  -0.608  -0.010  1.00  0.00           C  
HETATM   31  N   UNL     1      -5.789   1.299  -1.159  1.00  0.00           N  
HETATM   32  C   UNL     1      -8.081   0.464  -0.411  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.464   1.786   0.203  1.00  0.00           C  
HETATM   34  O   UNL     1      -7.602   2.578   0.523  1.00  0.00           O  
HETATM   35  N   UNL     1      -9.762   2.089   0.396  1.00  0.00           N  
HETATM   36  C   UNL     1     -10.134   3.374   0.994  1.00  0.00           C  
HETATM   37  H   UNL     1      -1.751   0.039  -0.854  1.00  0.00           H  
HETATM   38  H   UNL     1       4.729  -0.890   0.933  1.00  0.00           H  
HETATM   39  H   UNL     1       5.708   3.866   1.036  1.00  0.00           H  
HETATM   40  H   UNL     1       6.796   4.700  -0.101  1.00  0.00           H  
HETATM   41  H   UNL     1       2.796  -2.506  -3.648  1.00  0.00           H  
HETATM   42  H   UNL     1       1.506  -1.539  -2.892  1.00  0.00           H  
HETATM   43  H   UNL     1       3.185  -0.947  -2.882  1.00  0.00           H  
HETATM   44  H   UNL     1       4.899  -2.075  -1.457  1.00  0.00           H  
HETATM   45  H   UNL     1       4.442  -3.470  -0.452  1.00  0.00           H  
HETATM   46  H   UNL     1       4.510  -3.634  -2.223  1.00  0.00           H  
HETATM   47  H   UNL     1       0.084  -4.970   1.937  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.682   1.391  -1.447  1.00  0.00           H  
HETATM   49  H   UNL     1       7.873   2.407  -0.549  1.00  0.00           H  
HETATM   50  H   UNL     1       8.146   3.069   1.087  1.00  0.00           H  
HETATM   51  H   UNL     1       6.073   3.186  -1.901  1.00  0.00           H  
HETATM   52  H   UNL     1       4.713   4.088  -1.220  1.00  0.00           H  
HETATM   53  H   UNL     1       3.210   2.577  -2.190  1.00  0.00           H  
HETATM   54  H   UNL     1       1.915   0.512  -1.939  1.00  0.00           H  
HETATM   55  H   UNL     1       2.716  -2.081   0.607  1.00  0.00           H  
HETATM   56  H   UNL     1       2.167  -3.435  -1.437  1.00  0.00           H  
HETATM   57  H   UNL     1       0.704  -0.502  -0.802  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.193  -2.737   1.079  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.198  -1.469   0.543  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.521   0.384  -1.405  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.450  -0.348   0.215  1.00  0.00           H  
HETATM   62  H   UNL     1     -10.451   1.456   0.141  1.00  0.00           H  
HETATM   63  H   UNL     1      -9.694   3.454   1.988  1.00  0.00           H  
HETATM   64  H   UNL     1      -9.765   4.186   0.367  1.00  0.00           H  
HETATM   65  H   UNL     1     -11.219   3.439   1.070  1.00  0.00           H  
CONECT    1   32   30   31                                            
CONECT    2    7   14   14                                            
CONECT    3   30   30    4   15                                       
CONECT    4    3    5    5   29                                       
CONECT    5    4    4    6   37                                       
CONECT    6    5    7    7   28                                       
CONECT    7    6    6   26    2                                       
CONECT    8   24   22   22   10                                       
CONECT    9   21   21   23   20                                       
CONECT   10   23   23    8   38                                       
CONECT   11   19   20   39   40                                       
CONECT   12   25   41   42   43                                       
CONECT   13   25   44   45   46                                       
CONECT   14    2    2   27   47                                       
CONECT   15    3   31   31   48                                       
CONECT   16   17   17                                                 
CONECT   17   23   18   18   16                                       
CONECT   17   16   19                                                 
CONECT   18   17   17                                                 
CONECT   19   17   11   49   50                                       
CONECT   20   11    9   51   52                                       
CONECT   21   22    9    9   53                                       
CONECT   22    8    8   21   54                                       
CONECT   23    9   10   10   17                                       
CONECT   24   26    8   25   55                                       
CONECT   25   24   12   13   56                                       
CONECT   26    7   24   57                                            
CONECT   27   14   28   28                                            
CONECT   28   27   27    6   29                                       
CONECT   29   28    4   58                                            
CONECT   30    1    3    3   59                                       
CONECT   31   15   15    1                                            
CONECT   32   33    1   60   61                                       
CONECT   33   35   34   34   32                                       
CONECT   34   33   33                                                 
CONECT   35   36   33   62                                            
CONECT   36   35   63   64   65                                       
CONECT   37    5                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   32                                                      
CONECT   61   32                                                      
CONECT   62   35                                                      
CONECT   63   36                                                      
CONECT   64   36                                                      
CONECT   65   36                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
