COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.160   3.189  -0.384  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.898   2.835  -0.642  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.264   4.098   1.439  1.00  0.00           C  
HETATM    4  C   UNL     1       1.064   1.286  -0.711  1.00  0.00           C  
HETATM    5  C   UNL     1       2.273   0.909  -0.160  1.00  0.00           C  
HETATM    6  C   UNL     1       2.506  -0.411   0.197  1.00  0.00           C  
HETATM    7  C   UNL     1       1.531  -1.368   0.007  1.00  0.00           C  
HETATM    8  C   UNL     1       0.307  -1.000  -0.547  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.768  -1.982  -0.772  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.103  -0.261  -1.644  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.012  -2.506  -1.549  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.895  -2.572  -0.329  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.019  -1.778  -0.083  1.00  0.00           C  
HETATM   14  C   UNL     1       6.234   0.119  -0.310  1.00  0.00           C  
HETATM   15  C   UNL     1       7.353   0.354   0.707  1.00  0.00           C  
HETATM   16  C   UNL     1       7.221   1.271  -0.511  1.00  0.00           C  
HETATM   17  C   UNL     1       6.363  -1.092  -1.236  1.00  0.00           C  
HETATM   18  O   UNL     1       5.560  -1.310   1.577  1.00  0.00           O  
HETATM   19  S   UNL     1       4.099  -0.880   0.917  1.00  0.00           S  
HETATM   20  O   UNL     1       3.999  -2.360   0.172  1.00  0.00           O  
HETATM   21  N   UNL     1       4.865   0.463   0.097  1.00  0.00           N  
HETATM   22  C   UNL     1       0.072   0.338  -0.909  1.00  0.00           C  
HETATM   23  O   UNL     1      -0.617  -3.152  -0.477  1.00  0.00           O  
HETATM   24  N   UNL     1      -1.927  -1.550  -1.315  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.744  -3.415   0.718  1.00  0.00           C  
HETATM   26  N   UNL     1      -4.734  -3.159   1.599  1.00  0.00           N  
HETATM   27  C   UNL     1      -4.948  -3.842   2.877  1.00  0.00           C  
HETATM   28  N   UNL     1      -5.522  -2.127   1.073  1.00  0.00           N  
HETATM   29  O   UNL     1      -3.166   0.076  -2.130  1.00  0.00           O  
HETATM   30  N   UNL     1      -1.155   0.674  -1.460  1.00  0.00           N  
HETATM   31  C   UNL     1      -1.421   2.063  -1.845  1.00  0.00           C  
HETATM   32  S   UNL     1      -0.888   3.431   0.673  1.00  0.00           S  
HETATM   33  C   UNL     1      -2.245   4.851   2.744  1.00  0.00           C  
HETATM   34  N   UNL     1      -3.321   3.864   0.737  1.00  0.00           N  
HETATM   35  C   UNL     1      -4.306   2.851  -1.303  1.00  0.00           C  
HETATM   36  H   UNL     1       0.891   2.317  -0.983  1.00  0.00           H  
HETATM   37  H   UNL     1       3.045   1.648  -0.006  1.00  0.00           H  
HETATM   38  H   UNL     1       1.715  -2.395   0.286  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.591  -3.492  -1.747  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.602  -2.183  -2.407  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.406  -1.008  -0.735  1.00  0.00           H  
HETATM   42  H   UNL     1       7.073   0.762   1.678  1.00  0.00           H  
HETATM   43  H   UNL     1       8.181  -0.355   0.716  1.00  0.00           H  
HETATM   44  H   UNL     1       7.963   1.166  -1.303  1.00  0.00           H  
HETATM   45  H   UNL     1       6.855   2.283  -0.341  1.00  0.00           H  
HETATM   46  H   UNL     1       6.545  -1.986  -0.641  1.00  0.00           H  
HETATM   47  H   UNL     1       5.441  -1.214  -1.804  1.00  0.00           H  
HETATM   48  H   UNL     1       7.195  -0.936  -1.923  1.00  0.00           H  
HETATM   49  H   UNL     1       5.902  -0.676   2.221  1.00  0.00           H  
HETATM   50  H   UNL     1       3.198  -2.482  -0.356  1.00  0.00           H  
HETATM   51  H   UNL     1       4.856   1.291   0.673  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.970  -4.160   0.829  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.404  -3.320   3.664  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.013  -3.846   3.112  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.588  -4.868   2.805  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.190   2.085  -2.618  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.507   2.515  -2.228  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.098   5.913   2.549  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.193   4.704   3.262  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.431   4.479   3.366  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.671   1.849  -1.075  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.110   3.572  -1.162  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.964   2.886  -2.338  1.00  0.00           H  
CONECT    1    2    2   34   35                                       
CONECT    2    1    1   31   32                                       
CONECT    3   32   33   34   34                                       
CONECT    4    5    5   22   36                                       
CONECT    5    4    4    6   37                                       
CONECT    6    5    7    7   19                                       
CONECT    7    6    6    8   38                                       
CONECT    8    7    9   22   22                                       
CONECT    9    8   23   23   24                                       
CONECT   10   24   29   29   30                                       
CONECT   11   12   24   39   40                                       
CONECT   12   11   13   25   25                                       
CONECT   13   12   28   28   41                                       
CONECT   14   15   16   17   21                                       
CONECT   15   14   16   42   43                                       
CONECT   16   14   15   44   45                                       
CONECT   17   14   46   47   48                                       
CONECT   18   19   49                                                 
CONECT   19    6   18   20   21                                       
CONECT   20   19   50                                                 
CONECT   21   14   19   51                                            
CONECT   22    4    8    8   30                                       
CONECT   23    9    9                                                 
CONECT   24    9   10   11                                            
CONECT   25   12   12   26   52                                       
CONECT   26   25   27   28                                            
CONECT   27   26   53   54   55                                       
CONECT   28   13   13   26                                            
CONECT   29   10   10                                                 
CONECT   30   10   22   31                                            
CONECT   31    2   30   56   57                                       
CONECT   32    2    3                                                 
CONECT   33    3   58   59   60                                       
CONECT   34    1    3    3                                            
CONECT   35    1   61   62   63                                       
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   25                                                      
CONECT   53   27                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   33                                                      
CONECT   59   33                                                      
CONECT   60   33                                                      
CONECT   61   35                                                      
CONECT   62   35                                                      
CONECT   63   35                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
