COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.350   0.442   0.234  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.302  -0.866  -0.309  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.089   1.155   0.998  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.937  -1.048  -0.242  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.204   0.149  -0.470  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.383   1.460   0.597  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.725   0.969   1.056  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.028   1.482   0.798  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.835   0.394  -0.129  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.888   0.240   0.309  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.146  -0.133   0.440  1.00  0.00           C  
HETATM   12  C   UNL     1       3.839  -2.646  -0.244  1.00  0.00           C  
HETATM   13  C   UNL     1       1.670  -2.725   0.562  1.00  0.00           C  
HETATM   14  C   UNL     1       3.267  -1.229  -0.447  1.00  0.00           C  
HETATM   15  C   UNL     1       1.742  -1.404  -0.246  1.00  0.00           C  
HETATM   16  C   UNL     1       3.335   2.575  -0.582  1.00  0.00           C  
HETATM   17  C   UNL     1       5.631   2.693  -1.558  1.00  0.00           C  
HETATM   18  C   UNL     1       4.506   1.753  -1.122  1.00  0.00           C  
HETATM   19  N   UNL     1      -9.290  -0.045  -0.741  1.00  0.00           N  
HETATM   20  N   UNL     1       3.814  -0.308   0.553  1.00  0.00           N  
HETATM   21  O   UNL     1       6.073  -0.264  -0.350  1.00  0.00           O  
HETATM   22  O   UNL     1       5.375   1.369   1.372  1.00  0.00           O  
HETATM   23  O   UNL     1       2.728  -3.526  -0.007  1.00  0.00           O  
HETATM   24  O   UNL     1       1.199  -0.316   0.505  1.00  0.00           O  
HETATM   25  S   UNL     1      -5.478  -0.626  -0.589  1.00  0.00           S  
HETATM   26  S   UNL     1       5.116   0.643   0.178  1.00  0.00           S  
HETATM   27  H   UNL     1      -2.916  -1.576  -0.843  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.539   2.012   1.478  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.483  -1.903  -0.720  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.042   2.221   0.987  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.106   1.676   1.588  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.536   2.263   1.359  1.00  0.00           H  
HETATM   33  H   UNL     1       4.376  -2.960  -1.139  1.00  0.00           H  
HETATM   34  H   UNL     1       4.512  -2.655   0.614  1.00  0.00           H  
HETATM   35  H   UNL     1       1.856  -2.538   1.619  1.00  0.00           H  
HETATM   36  H   UNL     1       0.703  -3.208   0.420  1.00  0.00           H  
HETATM   37  H   UNL     1       3.484  -0.871  -1.453  1.00  0.00           H  
HETATM   38  H   UNL     1       1.233  -1.505  -1.204  1.00  0.00           H  
HETATM   39  H   UNL     1       3.667   3.165   0.272  1.00  0.00           H  
HETATM   40  H   UNL     1       2.968   3.242  -1.363  1.00  0.00           H  
HETATM   41  H   UNL     1       2.533   1.905  -0.271  1.00  0.00           H  
HETATM   42  H   UNL     1       5.964   3.283  -0.704  1.00  0.00           H  
HETATM   43  H   UNL     1       6.466   2.107  -1.943  1.00  0.00           H  
HETATM   44  H   UNL     1       5.265   3.360  -2.339  1.00  0.00           H  
HETATM   45  H   UNL     1       4.174   1.163  -1.976  1.00  0.00           H  
HETATM   46  H   UNL     1       3.413  -0.256   1.435  1.00  0.00           H  
CONECT    1   25   10    8    8                                       
CONECT    2    4   10   10   27                                       
CONECT    3    7    7   10   28                                       
CONECT    4   11   11    2   29                                       
CONECT    5   19   19   19    9                                       
CONECT    6    9    9    8   30                                       
CONECT    7   11    3    3   31                                       
CONECT    8    1    1    6   32                                       
CONECT    9   25    5    6    6                                       
CONECT   10    2    2    3    1                                       
CONECT   11   24    4    4    7                                       
CONECT   12   23   14   33   34                                       
CONECT   13   23   15   35   36                                       
CONECT   14   15   12   20   37                                       
CONECT   15   13   24   14   38                                       
CONECT   16   18   39   40   41                                       
CONECT   17   18   42   43   44                                       
CONECT   18   26   17   16   45                                       
CONECT   19    5    5    5                                            
CONECT   20   14   26   46                                            
CONECT   21   26   26                                                 
CONECT   22   26   26                                                 
CONECT   23   13   12                                                 
CONECT   24   15   11                                                 
CONECT   25    9    1                                                 
CONECT   26   20   22   22   18                                       
CONECT   26   21   21                                                 
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   20                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
