COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.753  -0.242  -0.845  1.00  0.00           O  
HETATM    2  C   UNL     1       2.498   0.802  -0.277  1.00  0.00           C  
HETATM    3  O   UNL     1       3.497   1.626   0.098  1.00  0.00           O  
HETATM    4  C   UNL     1       4.852   1.202  -0.208  1.00  0.00           C  
HETATM    5  C   UNL     1       5.842   2.257   0.289  1.00  0.00           C  
HETATM    6  C   UNL     1       1.101   1.170  -0.005  1.00  0.00           C  
HETATM    7  C   UNL     1       0.799   2.375   0.650  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.435   2.727   0.905  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.481   1.961   0.557  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.792   2.369   0.845  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.845   1.584   0.486  1.00  0.00           C  
HETATM   12  C   UNL     1       0.054   0.323  -0.403  1.00  0.00           C  
HETATM   13  S   UNL     1       0.377  -1.197  -1.234  1.00  0.00           S  
HETATM   14  C   UNL     1       0.518  -2.308   0.188  1.00  0.00           C  
HETATM   15  C   UNL     1       0.807  -3.729  -0.302  1.00  0.00           C  
HETATM   16  C   UNL     1       0.922  -4.633   0.854  1.00  0.00           C  
HETATM   17  N   UNL     1       1.010  -5.330   1.746  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.271   0.730  -0.108  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.369  -0.060  -0.473  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.643   0.368  -0.170  1.00  0.00           C  
HETATM   21  O   UNL     1      -4.712  -0.395  -0.522  1.00  0.00           O  
HETATM   22  C   UNL     1      -6.007   0.105  -0.179  1.00  0.00           C  
HETATM   23  H   UNL     1       5.055   0.252   0.285  1.00  0.00           H  
HETATM   24  H   UNL     1       4.960   1.082  -1.286  1.00  0.00           H  
HETATM   25  H   UNL     1       5.638   3.208  -0.204  1.00  0.00           H  
HETATM   26  H   UNL     1       5.734   2.377   1.367  1.00  0.00           H  
HETATM   27  H   UNL     1       6.859   1.939   0.059  1.00  0.00           H  
HETATM   28  H   UNL     1       1.605   3.028   0.952  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.967   3.307   1.352  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.851   1.906   0.712  1.00  0.00           H  
HETATM   31  H   UNL     1       1.332  -1.974   0.831  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.416  -2.300   0.750  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.007  -4.063  -0.945  1.00  0.00           H  
HETATM   34  H   UNL     1       1.741  -3.737  -0.864  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.217  -0.998  -0.987  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.163   1.070  -0.663  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.768  -0.598  -0.516  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.075   0.226   0.902  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    6                                       
CONECT    3    4    2                                                 
CONECT    4    5    3   23   24                                       
CONECT    5    4   25   26   27                                       
CONECT    6    2   12   12    7                                       
CONECT    7    6    8    8   28                                       
CONECT    8    7    7    9                                            
CONECT    9   18    8   10   10                                       
CONECT   10    9    9   11   29                                       
CONECT   11   20   20   10   30                                       
CONECT   12   13    6    6   18                                       
CONECT   13   14   12                                                 
CONECT   14   13   15   31   32                                       
CONECT   15   14   16   33   34                                       
CONECT   16   17   17   17   15                                       
CONECT   17   16   16   16                                            
CONECT   18   12   19   19    9                                       
CONECT   19   18   18   20   35                                       
CONECT   20   19   21   11   11                                       
CONECT   21   22   20                                                 
CONECT   22   21   36   37   38                                       
CONECT   23    4                                                      
CONECT   24    4                                                      
CONECT   25    5                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    7                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   14                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   19                                                      
CONECT   36   22                                                      
CONECT   37   22                                                      
CONECT   38   22                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
