COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.445  -1.655  -0.307  1.00  0.00           N  
HETATM    2  C   UNL     1       3.635  -2.164   0.831  1.00  0.00           C  
HETATM    3  C   UNL     1       3.408  -0.970   0.115  1.00  0.00           C  
HETATM    4  C   UNL     1       2.164  -0.170   0.119  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.105   0.263  -0.036  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.765   0.747  -0.329  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.330  -0.978  -1.007  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.637  -2.678   0.574  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.606   2.607   0.288  1.00  0.00           C  
HETATM   10  C   UNL     1       4.766   0.492  -1.496  1.00  0.00           C  
HETATM   11  C   UNL     1       4.549  -0.688  -0.583  1.00  0.00           C  
HETATM   12  N   UNL     1       4.852  -2.564   0.576  1.00  0.00           N  
HETATM   13  C   UNL     1       0.934  -0.666  -0.081  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.451   0.062  -0.205  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.299   1.039  -0.134  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.949  -0.689  -0.578  1.00  0.00           N  
HETATM   17  C   UNL     1      -5.908  -2.014  -0.021  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.659  -1.479   0.638  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.911   2.318   0.110  1.00  0.00           N  
HETATM   20  O   UNL     1      -0.248   3.753   0.508  1.00  0.00           O  
HETATM   21  C   UNL     1       0.339   1.559   0.216  1.00  0.00           C  
HETATM   22  S   UNL     1       2.088   1.563   0.394  1.00  0.00           S  
HETATM   23  H   UNL     1       6.346  -1.714  -0.663  1.00  0.00           H  
HETATM   24  H   UNL     1       2.928  -2.658   1.481  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.315   1.034   0.567  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.138   1.314  -1.182  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.925  -0.066  -0.978  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.325  -1.390  -2.017  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.834  -3.076   1.569  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.258  -3.457  -0.088  1.00  0.00           H  
HETATM   31  H   UNL     1       4.468   0.226  -2.510  1.00  0.00           H  
HETATM   32  H   UNL     1       4.166   1.334  -1.150  1.00  0.00           H  
HETATM   33  H   UNL     1       5.820   0.769  -1.488  1.00  0.00           H  
HETATM   34  H   UNL     1       0.760  -1.716  -0.266  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.486  -1.521   0.761  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.516  -2.750  -0.547  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.847  -0.883   1.531  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.627  -1.830   0.626  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.575   3.025   0.156  1.00  0.00           H  
CONECT    1   12   11   23                                            
CONECT    2   12   12    3   24                                       
CONECT    3    2   11   11    4                                       
CONECT    4   13   13    3   22                                       
CONECT    5   13   14   21   21                                       
CONECT    6   15   16   25   26                                       
CONECT    7   16   17   27   28                                       
CONECT    8   18   17   29   30                                       
CONECT    9   21   19   20   20                                       
CONECT   10   11   31   32   33                                       
CONECT   11    1    3    3   10                                       
CONECT   12    2    2    1                                            
CONECT   13    4    4    5   34                                       
CONECT   14    5   15   15                                            
CONECT   15   14   14    6   19                                       
CONECT   16    6   18    7                                            
CONECT   17    7    8   35   36                                       
CONECT   18   16    8   37   38                                       
CONECT   19   15    9   39                                            
CONECT   20    9    9                                                 
CONECT   21    5    5   22    9                                       
CONECT   22    4   21                                                 
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    6                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31   10                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   13                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
