COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.479  -1.758   0.046  1.00  0.00           N  
HETATM    2  C   UNL     1       4.622  -1.116   0.252  1.00  0.00           C  
HETATM    3  N   UNL     1       4.696   0.202   0.240  1.00  0.00           N  
HETATM    4  C   UNL     1       3.609   0.951   0.017  1.00  0.00           C  
HETATM    5  C   UNL     1       2.381   0.321  -0.205  1.00  0.00           C  
HETATM    6  C   UNL     1       2.355  -1.097  -0.182  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.884   1.139  -0.022  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.890  -3.447  -0.283  1.00  0.00           C  
HETATM    9  N   UNL     1       5.773  -1.851   0.487  1.00  0.00           N  
HETATM   10  N   UNL     1       1.171  -1.780  -0.394  1.00  0.00           N  
HETATM   11  C   UNL     1      -4.848  -0.636  -0.109  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.831  -1.570  -0.162  1.00  0.00           C  
HETATM   13  C   UNL     1       1.683   2.542  -0.382  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.248   1.074   0.428  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.809   0.561   0.638  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.111   0.858  -0.691  1.00  0.00           C  
HETATM   17  O   UNL     1      -5.559   1.607   0.239  1.00  0.00           O  
HETATM   18  O   UNL     1      -1.520  -2.102   0.027  1.00  0.00           O  
HETATM   19  S   UNL     1       3.399   2.695  -0.058  1.00  0.00           S  
HETATM   20  C   UNL     1      -4.558   0.688   0.186  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.232   0.141   0.375  1.00  0.00           C  
HETATM   22  C   UNL     1       1.312   1.278  -0.428  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.521  -1.183   0.079  1.00  0.00           C  
HETATM   24  H   UNL     1      -7.584   1.971   0.052  1.00  0.00           H  
HETATM   25  H   UNL     1      -6.929   0.714  -1.025  1.00  0.00           H  
HETATM   26  H   UNL     1      -7.150   0.375   0.709  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.000  -4.076  -0.293  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.587  -3.815   0.470  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.367  -3.477  -1.263  1.00  0.00           H  
HETATM   30  H   UNL     1       5.735  -2.820   0.499  1.00  0.00           H  
HETATM   31  H   UNL     1       6.616  -1.396   0.639  1.00  0.00           H  
HETATM   32  H   UNL     1       1.181  -2.742  -0.515  1.00  0.00           H  
HETATM   33  H   UNL     1       0.331  -1.296  -0.422  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.867  -0.936  -0.302  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.056  -2.601  -0.392  1.00  0.00           H  
HETATM   36  H   UNL     1       1.014   3.378  -0.527  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.023   2.105   0.658  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.282  -0.243   1.153  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.803   1.456   1.260  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.117  -0.037  -1.313  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.637   1.662  -1.206  1.00  0.00           H  
CONECT    1    2    2    6                                            
CONECT    2    1    1    3    9                                       
CONECT    3    2    4    4                                            
CONECT    4    3    3   19    5                                       
CONECT    5    4   22    6    6                                       
CONECT    6    1    5    5   10                                       
CONECT    7   17   24   25   26                                       
CONECT    8   18   27   28   29                                       
CONECT    9    2   30   31                                            
CONECT   10    6   32   33                                            
CONECT   11   20   20   12   34                                       
CONECT   12   11   23   23   35                                       
CONECT   13   19   22   22   36                                       
CONECT   14   20   21   21   37                                       
CONECT   15   21   16   38   39                                       
CONECT   16   15   22   40   41                                       
CONECT   17    7   20                                                 
CONECT   18    8   23                                                 
CONECT   19    4   13                                                 
CONECT   20   11   11   14   17                                       
CONECT   21   14   14   15   23                                       
CONECT   22    5   13   13   16                                       
CONECT   23   12   12   18   21                                       
CONECT   24    7                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28    8                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
