COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.816   0.475  -0.371  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.034   0.658   0.242  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.313  -0.809  -0.535  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.748  -0.449   0.701  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.021  -1.905  -0.087  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.241  -1.727   0.536  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.838   2.882  -1.025  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.591   3.112   0.290  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.984   1.624  -0.878  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.648   2.019   0.439  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.627  -1.446   1.762  1.00  0.00           C  
HETATM   12  C   UNL     1       3.414   0.980  -0.737  1.00  0.00           C  
HETATM   13  C   UNL     1       1.884   1.019  -0.651  1.00  0.00           C  
HETATM   14  C   UNL     1       3.977   0.370   0.549  1.00  0.00           C  
HETATM   15  C   UNL     1       3.466  -1.064   0.702  1.00  0.00           C  
HETATM   16  C   UNL     1       1.938  -1.049   0.804  1.00  0.00           C  
HETATM   17  C   UNL     1       5.506   0.362   0.481  1.00  0.00           C  
HETATM   18  N   UNL     1       1.392  -0.334  -0.360  1.00  0.00           N  
HETATM   19  O   UNL     1      -4.947  -0.271   1.314  1.00  0.00           O  
HETATM   20  O   UNL     1       3.555   1.149   1.670  1.00  0.00           O  
HETATM   21  O   UNL     1       6.030  -0.311   1.627  1.00  0.00           O  
HETATM   22  O   UNL     1       0.505  -2.438  -1.296  1.00  0.00           O  
HETATM   23  O   UNL     1       0.206  -0.282  -2.523  1.00  0.00           O  
HETATM   24  S   UNL     1       0.246  -1.041  -1.323  1.00  0.00           S  
HETATM   25  H   UNL     1      -1.622  -2.899  -0.220  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.799  -2.580   0.893  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.552   2.749  -1.838  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.197   3.738  -1.236  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.893   3.062   1.126  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.072   4.089   0.272  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.174   1.819  -0.176  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.562   1.361  -1.848  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.429   2.172  -0.305  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.085   2.076   1.436  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.569  -1.163   2.233  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.826  -2.097   0.911  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.003  -1.973   2.484  1.00  0.00           H  
HETATM   38  H   UNL     1       3.715   0.373  -1.590  1.00  0.00           H  
HETATM   39  H   UNL     1       3.797   1.993  -0.858  1.00  0.00           H  
HETATM   40  H   UNL     1       1.580   1.698   0.145  1.00  0.00           H  
HETATM   41  H   UNL     1       1.474   1.363  -1.601  1.00  0.00           H  
HETATM   42  H   UNL     1       3.767  -1.652  -0.165  1.00  0.00           H  
HETATM   43  H   UNL     1       3.887  -1.506   1.605  1.00  0.00           H  
HETATM   44  H   UNL     1       1.562  -2.072   0.814  1.00  0.00           H  
HETATM   45  H   UNL     1       1.638  -0.538   1.719  1.00  0.00           H  
HETATM   46  H   UNL     1       5.827  -0.155  -0.423  1.00  0.00           H  
HETATM   47  H   UNL     1       5.874   1.388   0.463  1.00  0.00           H  
HETATM   48  H   UNL     1       3.876   0.820   2.521  1.00  0.00           H  
HETATM   49  H   UNL     1       6.996  -0.355   1.651  1.00  0.00           H  
CONECT    1    2    2    3    9                                       
CONECT    2    4   10    1    1                                       
CONECT    3    5    5    1   24                                       
CONECT    4   19    6    6    2                                       
CONECT    5    6    3    3   25                                       
CONECT    6    4    4    5   26                                       
CONECT    7    8    9   27   28                                       
CONECT    8   10    7   29   30                                       
CONECT    9    1    7   31   32                                       
CONECT   10    2    8   33   34                                       
CONECT   11   19   35   36   37                                       
CONECT   12   14   13   38   39                                       
CONECT   13   18   12   40   41                                       
CONECT   14   15   20   17   12                                       
CONECT   15   16   14   42   43                                       
CONECT   16   15   18   44   45                                       
CONECT   17   21   14   46   47                                       
CONECT   18   16   24   13                                            
CONECT   19   11    4                                                 
CONECT   20   14   48                                                 
CONECT   21   17   49                                                 
CONECT   22   24   24                                                 
CONECT   23   24   24                                                 
CONECT   24    3   22   22   18                                       
CONECT   24   23   23                                                 
CONECT   25    5                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
