COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.075  -0.761  -0.683  1.00  0.00           C  
HETATM    2  N   UNL     1      -4.021  -0.367   0.256  1.00  0.00           N  
HETATM    3  C   UNL     1      -6.401  -0.901   0.068  1.00  0.00           C  
HETATM    4  N   UNL     1     -10.500  -0.339   1.124  1.00  0.00           N  
HETATM    5  C   UNL     1      -7.473  -1.432  -0.886  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.799  -1.571  -0.135  1.00  0.00           C  
HETATM    7  C   UNL     1      -9.227  -0.205   0.403  1.00  0.00           C  
HETATM    8  C   UNL     1      -8.154   0.326   1.357  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.828   0.466   0.606  1.00  0.00           C  
HETATM   10  N   UNL     1       1.533   0.240  -0.891  1.00  0.00           N  
HETATM   11  C   UNL     1       1.109   1.505  -1.106  1.00  0.00           C  
HETATM   12  O   UNL     1       1.713   2.366  -1.716  1.00  0.00           O  
HETATM   13  N   UNL     1      -0.086   1.645  -0.534  1.00  0.00           N  
HETATM   14  N   UNL     1      -0.412   0.403   0.063  1.00  0.00           N  
HETATM   15  C   UNL     1       0.598  -0.430  -0.182  1.00  0.00           C  
HETATM   16  O   UNL     1       0.670  -1.589   0.177  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.004   2.784  -0.452  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.728   2.690   0.872  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.029   1.544   1.423  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.677   0.221   0.781  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.761  -0.184  -0.184  1.00  0.00           C  
HETATM   22  O   UNL     1      -2.499  -0.345  -1.357  1.00  0.00           O  
HETATM   23  C   UNL     1       2.805  -0.319  -1.358  1.00  0.00           C  
HETATM   24  C   UNL     1       3.882  -0.092  -0.296  1.00  0.00           C  
HETATM   25  S   UNL     1       5.456  -0.784  -0.874  1.00  0.00           S  
HETATM   26  O   UNL     1       5.388  -2.202  -0.928  1.00  0.00           O  
HETATM   27  O   UNL     1       5.958  -0.032  -1.970  1.00  0.00           O  
HETATM   28  C   UNL     1       6.589  -0.453   0.435  1.00  0.00           C  
HETATM   29  C   UNL     1       6.757  -1.374   1.452  1.00  0.00           C  
HETATM   30  C   UNL     1       7.645  -1.115   2.479  1.00  0.00           C  
HETATM   31  C   UNL     1       8.366   0.065   2.489  1.00  0.00           C  
HETATM   32  C   UNL     1       8.197   0.986   1.471  1.00  0.00           C  
HETATM   33  C   UNL     1       7.314   0.724   0.441  1.00  0.00           C  
HETATM   34  H   UNL     1      -5.174  -0.001  -1.457  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.815  -1.715  -1.141  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.231  -0.238   1.194  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.277  -1.596   0.898  1.00  0.00           H  
HETATM   38  H   UNL     1     -10.804   0.551   1.490  1.00  0.00           H  
HETATM   39  H   UNL     1     -11.208  -0.748   0.534  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.597  -0.737  -1.716  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.168  -2.406  -1.269  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.563  -1.950  -0.814  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.675  -2.266   0.696  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.351   0.490  -0.427  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.459   1.300   1.740  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.030  -0.368   2.187  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.065   0.845   1.285  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.953   1.161  -0.225  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.441   3.717  -0.499  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.720   2.743  -1.272  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.007   3.601   1.379  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.548   1.542   2.370  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.560  -0.543   1.550  1.00  0.00           H  
HETATM   54  H   UNL     1       2.688  -1.388  -1.535  1.00  0.00           H  
HETATM   55  H   UNL     1       3.099   0.174  -2.285  1.00  0.00           H  
HETATM   56  H   UNL     1       3.999   0.977  -0.118  1.00  0.00           H  
HETATM   57  H   UNL     1       3.588  -0.584   0.632  1.00  0.00           H  
HETATM   58  H   UNL     1       6.194  -2.296   1.445  1.00  0.00           H  
HETATM   59  H   UNL     1       7.776  -1.834   3.274  1.00  0.00           H  
HETATM   60  H   UNL     1       9.059   0.268   3.291  1.00  0.00           H  
HETATM   61  H   UNL     1       8.760   1.908   1.479  1.00  0.00           H  
HETATM   62  H   UNL     1       7.182   1.443  -0.354  1.00  0.00           H  
CONECT    1    3    2   34   35                                       
CONECT    2    1   21   36                                            
CONECT    3    1    9    5   37                                       
CONECT    4    7   38   39                                            
CONECT    5    3    6   40   41                                       
CONECT    6    5    7   42   43                                       
CONECT    7    4    6    8   44                                       
CONECT    8    7    9   45   46                                       
CONECT    9    3    8   47   48                                       
CONECT   10   11   15   23                                            
CONECT   11   10   13   12   12                                       
CONECT   12   11   11                                                 
CONECT   13   11   17   14                                            
CONECT   14   13   20   15                                            
CONECT   15   10   14   16   16                                       
CONECT   16   15   15                                                 
CONECT   17   13   18   49   50                                       
CONECT   18   17   19   19   51                                       
CONECT   19   18   18   20   52                                       
CONECT   20   14   19   21   53                                       
CONECT   21    2   20   22   22                                       
CONECT   22   21   21                                                 
CONECT   23   10   24   54   55                                       
CONECT   24   23   25   56   57                                       
CONECT   25   24   27   27   28                                       
CONECT   25   26   26                                                 
CONECT   26   25   25                                                 
CONECT   27   25   25                                                 
CONECT   28   25   33   33   29                                       
CONECT   29   28   30   30   58                                       
CONECT   30   29   29   31   59                                       
CONECT   31   30   32   32   60                                       
CONECT   32   31   31   33   61                                       
CONECT   33   28   28   32   62                                       
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   31                                                      
CONECT   61   32                                                      
CONECT   62   33                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
