COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.141  -2.626   0.474  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.200  -2.752   0.261  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.996  -1.610   0.130  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.410  -0.333   0.220  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.041  -0.221   0.438  1.00  0.00           C  
HETATM    6  C   UNL     1       0.729  -1.363   0.564  1.00  0.00           C  
HETATM    7  N   UNL     1      -3.629  -0.100  -0.135  1.00  0.00           N  
HETATM    8  N   UNL     1      -2.423   0.581   0.056  1.00  0.00           N  
HETATM    9  C   UNL     1      -3.426  -1.391  -0.099  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.972   4.722   0.118  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.901   4.142  -0.725  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.053   2.769  -0.749  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.271   1.971   0.076  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.338   2.557   0.923  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.191   3.930   0.941  1.00  0.00           C  
HETATM   16  S   UNL     1      -4.651  -2.643  -0.291  1.00  0.00           S  
HETATM   17  C   UNL     1      -6.174  -1.688  -0.536  1.00  0.00           C  
HETATM   18  C   UNL     1       2.801  -0.249   0.212  1.00  0.00           C  
HETATM   19  N   UNL     1       2.105  -1.252   0.784  1.00  0.00           N  
HETATM   20  O   UNL     1       2.221   0.604  -0.426  1.00  0.00           O  
HETATM   21  C   UNL     1       6.365   1.061  -0.270  1.00  0.00           C  
HETATM   22  C   UNL     1       4.839   1.038  -0.377  1.00  0.00           C  
HETATM   23  C   UNL     1       4.299  -0.188   0.364  1.00  0.00           C  
HETATM   24  C   UNL     1       4.925  -1.452  -0.233  1.00  0.00           C  
HETATM   25  C   UNL     1       6.450  -1.356  -0.130  1.00  0.00           C  
HETATM   26  N   UNL     1       6.917  -0.168  -0.855  1.00  0.00           N  
HETATM   27  H   UNL     1       0.753  -3.510   0.579  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.646  -3.734   0.192  1.00  0.00           H  
HETATM   29  H   UNL     1       0.419   0.754   0.508  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.852   5.795   0.131  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.509   4.763  -1.367  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.780   2.317  -1.407  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.728   1.940   1.566  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.466   4.386   1.598  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.352  -1.058   0.335  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.072  -1.062  -1.423  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.014  -2.371  -0.668  1.00  0.00           H  
HETATM   38  H   UNL     1       2.560  -1.896   1.349  1.00  0.00           H  
HETATM   39  H   UNL     1       6.754   1.926  -0.808  1.00  0.00           H  
HETATM   40  H   UNL     1       6.655   1.127   0.779  1.00  0.00           H  
HETATM   41  H   UNL     1       4.429   1.944   0.072  1.00  0.00           H  
HETATM   42  H   UNL     1       4.548   0.987  -1.426  1.00  0.00           H  
HETATM   43  H   UNL     1       4.555  -0.118   1.421  1.00  0.00           H  
HETATM   44  H   UNL     1       4.578  -2.325   0.318  1.00  0.00           H  
HETATM   45  H   UNL     1       4.636  -1.542  -1.280  1.00  0.00           H  
HETATM   46  H   UNL     1       6.739  -1.280   0.918  1.00  0.00           H  
HETATM   47  H   UNL     1       6.899  -2.248  -0.567  1.00  0.00           H  
HETATM   48  H   UNL     1       6.694  -0.232  -1.837  1.00  0.00           H  
CONECT    1    2    2    6   27                                       
CONECT    2    1    1    3   28                                       
CONECT    3    2    4    4    9                                       
CONECT    4    3    3    5    8                                       
CONECT    5    4    6    6   29                                       
CONECT    6    1    5    5   19                                       
CONECT    7    8    9    9                                            
CONECT    8    4    7   13                                            
CONECT    9    3    7    7   16                                       
CONECT   10   11   11   15   30                                       
CONECT   11   10   10   12   31                                       
CONECT   12   11   13   13   32                                       
CONECT   13    8   12   12   14                                       
CONECT   14   13   15   15   33                                       
CONECT   15   10   14   14   34                                       
CONECT   16    9   17                                                 
CONECT   17   16   35   36   37                                       
CONECT   18   19   20   20   23                                       
CONECT   19    6   18   38                                            
CONECT   20   18   18                                                 
CONECT   21   22   26   39   40                                       
CONECT   22   21   23   41   42                                       
CONECT   23   18   22   24   43                                       
CONECT   24   23   25   44   45                                       
CONECT   25   24   26   46   47                                       
CONECT   26   21   25   48                                            
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    5                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   17                                                      
CONECT   38   19                                                      
CONECT   39   21                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
