COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.937   1.670   1.206  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.275   1.564   0.051  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.360   0.896  -0.943  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.061  -0.336  -1.508  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.733  -0.729  -0.260  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.554  -1.139   0.342  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.182  -2.599   0.346  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.190  -3.327   1.692  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.288  -3.608   0.663  1.00  0.00           C  
HETATM   10  C   UNL     1       0.289  -0.210   0.942  1.00  0.00           C  
HETATM   11  C   UNL     1       1.574  -0.645   1.599  1.00  0.00           C  
HETATM   12  C   UNL     1       2.665  -0.724   0.563  1.00  0.00           C  
HETATM   13  C   UNL     1       2.946  -1.908  -0.047  1.00  0.00           C  
HETATM   14  C   UNL     1       3.951  -2.000  -1.007  1.00  0.00           C  
HETATM   15  C   UNL     1       4.682  -0.909  -1.363  1.00  0.00           C  
HETATM   16  C   UNL     1       4.422   0.331  -0.756  1.00  0.00           C  
HETATM   17  C   UNL     1       5.156   1.480  -1.097  1.00  0.00           C  
HETATM   18  C   UNL     1       4.876   2.664  -0.488  1.00  0.00           C  
HETATM   19  C   UNL     1       3.870   2.756   0.473  1.00  0.00           C  
HETATM   20  O   UNL     1      -5.468   2.035  -0.345  1.00  0.00           O  
HETATM   21  S   UNL     1      -2.955  -1.713  -1.081  1.00  0.00           S  
HETATM   22  C   UNL     1       3.139   1.665   0.829  1.00  0.00           C  
HETATM   23  C   UNL     1       3.395   0.426   0.217  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.080   1.119   0.921  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.271   1.494   0.308  1.00  0.00           C  
HETATM   26  O   UNL     1      -1.588   2.674   0.295  1.00  0.00           O  
HETATM   27  N   UNL     1      -2.096   0.577  -0.281  1.00  0.00           N  
HETATM   28  H   UNL     1      -3.161   1.592  -1.759  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.035  -0.470  -1.037  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.167  -0.253  -2.589  1.00  0.00           H  
HETATM   31  H   UNL     1       0.575  -2.894  -0.381  1.00  0.00           H  
HETATM   32  H   UNL     1       0.561  -4.100   1.850  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.464  -2.749   2.574  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.283  -3.216   0.869  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.258  -4.567   0.145  1.00  0.00           H  
HETATM   36  H   UNL     1       1.852   0.078   2.365  1.00  0.00           H  
HETATM   37  H   UNL     1       1.435  -1.624   2.056  1.00  0.00           H  
HETATM   38  H   UNL     1       2.380  -2.790   0.218  1.00  0.00           H  
HETATM   39  H   UNL     1       4.153  -2.952  -1.475  1.00  0.00           H  
HETATM   40  H   UNL     1       5.459  -0.996  -2.109  1.00  0.00           H  
HETATM   41  H   UNL     1       5.938   1.423  -1.839  1.00  0.00           H  
HETATM   42  H   UNL     1       5.441   3.545  -0.752  1.00  0.00           H  
HETATM   43  H   UNL     1       3.668   3.708   0.942  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.021   2.451   0.329  1.00  0.00           H  
HETATM   45  H   UNL     1       2.363   1.751   1.576  1.00  0.00           H  
HETATM   46  H   UNL     1       0.553   1.865   1.379  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   20                                       
CONECT    3    2   27    4   28                                       
CONECT    4    3   21   29   30                                       
CONECT    5   27    6    6   21                                       
CONECT    6   10    5    5    7                                       
CONECT    7    6    8    9   31                                       
CONECT    8    7    9   32   33                                       
CONECT    9    7    8   34   35                                       
CONECT   10   24   24   11    6                                       
CONECT   11   12   10   36   37                                       
CONECT   12   23   23   13   11                                       
CONECT   13   14   14   12   38                                       
CONECT   14   15   13   13   39                                       
CONECT   15   16   16   14   40                                       
CONECT   16   17   15   15   23                                       
CONECT   17   18   18   16   41                                       
CONECT   18   17   17   19   42                                       
CONECT   19   18   22   22   43                                       
CONECT   20    2   44                                                 
CONECT   21    5    4                                                 
CONECT   22   19   19   23   45                                       
CONECT   23   16   22   12   12                                       
CONECT   24   25   10   10   46                                       
CONECT   25   26   26   24   27                                       
CONECT   26   25   25                                                 
CONECT   27   25    3    5                                            
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   24                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
