COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.657   1.074   0.068  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.007  -2.105   1.020  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.422  -0.166  -0.597  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.650   2.310  -0.888  1.00  0.00           C  
HETATM    5  C   UNL     1       2.638   0.588  -0.379  1.00  0.00           C  
HETATM    6  C   UNL     1       2.881  -0.652  -0.953  1.00  0.00           C  
HETATM    7  C   UNL     1       3.058  -0.756  -2.325  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.344  -0.259   0.304  1.00  0.00           C  
HETATM    9  C   UNL     1       2.992   0.375  -3.116  1.00  0.00           C  
HETATM   10  C   UNL     1       2.750   1.609  -2.543  1.00  0.00           C  
HETATM   11  C   UNL     1       2.568   1.714  -1.176  1.00  0.00           C  
HETATM   12  C   UNL     1       3.199  -3.004  -0.831  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.147  -0.720   0.854  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.181   0.252   1.194  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.483   1.585   0.964  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.689   2.003   0.409  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.404  -1.091  -0.089  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.226  -2.453   0.091  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.037  -2.927   0.639  1.00  0.00           C  
HETATM   20  N   UNL     1      -3.935   1.097  -0.483  1.00  0.00           N  
HETATM   21  N   UNL     1       1.041  -0.119   1.747  1.00  0.00           N  
HETATM   22  O   UNL     1      -5.511  -0.476  -1.043  1.00  0.00           O  
HETATM   23  O   UNL     1       2.946  -1.762  -0.172  1.00  0.00           O  
HETATM   24  O   UNL     1       3.495   0.026   1.963  1.00  0.00           O  
HETATM   25  O   UNL     1       2.130   2.092   1.625  1.00  0.00           O  
HETATM   26  S   UNL     1       2.413   0.725   1.363  1.00  0.00           S  
HETATM   27  H   UNL     1      -0.102  -2.519   1.440  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.423   2.535  -1.930  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.723   2.154  -0.776  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.337   3.144  -0.259  1.00  0.00           H  
HETATM   31  H   UNL     1       3.247  -1.720  -2.774  1.00  0.00           H  
HETATM   32  H   UNL     1       3.134   0.295  -4.184  1.00  0.00           H  
HETATM   33  H   UNL     1       2.699   2.491  -3.163  1.00  0.00           H  
HETATM   34  H   UNL     1       2.379   2.680  -0.730  1.00  0.00           H  
HETATM   35  H   UNL     1       2.407  -3.201  -1.554  1.00  0.00           H  
HETATM   36  H   UNL     1       4.158  -2.953  -1.347  1.00  0.00           H  
HETATM   37  H   UNL     1       3.226  -3.807  -0.094  1.00  0.00           H  
HETATM   38  H   UNL     1       0.252   2.333   1.223  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.871   3.056   0.245  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.006  -3.144  -0.191  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.920  -3.992   0.771  1.00  0.00           H  
HETATM   42  H   UNL     1       1.089  -0.871   2.358  1.00  0.00           H  
CONECT    1    8    8   20   16                                       
CONECT    2   19   19   13   27                                       
CONECT    3   17   22   22   20                                       
CONECT    4   20   28   29   30                                       
CONECT    5   11   11    6   26                                       
CONECT    6    7    7    5   23                                       
CONECT    7    9    6    6   31                                       
CONECT    8   13   17    1    1                                       
CONECT    9   10   10    7   32                                       
CONECT   10    9    9   11   33                                       
CONECT   11   10    5    5   34                                       
CONECT   12   23   35   36   37                                       
CONECT   13    2   14   14    8                                       
CONECT   14   21   13   13   15                                       
CONECT   15   14   16   16   38                                       
CONECT   16   15   15    1   39                                       
CONECT   17   18   18    8    3                                       
CONECT   18   19   17   17   40                                       
CONECT   19    2    2   18   41                                       
CONECT   20    3    1    4                                            
CONECT   21   26   14   42                                            
CONECT   22    3    3                                                 
CONECT   23    6   12                                                 
CONECT   24   26   26                                                 
CONECT   25   26   26                                                 
CONECT   26    5   25   25   24                                       
CONECT   26   24   21                                                 
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
