COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.273  -0.591   0.383  1.00  0.00           N  
HETATM    2  C   UNL     1       3.197  -0.917  -0.920  1.00  0.00           C  
HETATM    3  O   UNL     1       2.526  -0.231  -1.672  1.00  0.00           O  
HETATM    4  N   UNL     1       3.844  -1.977  -1.403  1.00  0.00           N  
HETATM    5  C   UNL     1       4.581  -2.741  -0.607  1.00  0.00           C  
HETATM    6  N   UNL     1       5.245  -3.833  -1.116  1.00  0.00           N  
HETATM    7  C   UNL     1       4.681  -2.427   0.764  1.00  0.00           C  
HETATM    8  C   UNL     1       4.018  -1.345   1.239  1.00  0.00           C  
HETATM    9  C   UNL     1       2.556   0.585   0.883  1.00  0.00           C  
HETATM   10  C   UNL     1       3.089   1.875   0.210  1.00  0.00           C  
HETATM   11  O   UNL     1       4.221   2.388   0.915  1.00  0.00           O  
HETATM   12  C   UNL     1       1.878   2.831   0.339  1.00  0.00           C  
HETATM   13  O   UNL     1       2.040   3.695   1.466  1.00  0.00           O  
HETATM   14  C   UNL     1      -2.596   1.346  -1.139  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.591   2.122  -2.078  1.00  0.00           O  
HETATM   16  C   UNL     1      -3.702   0.484  -0.938  1.00  0.00           C  
HETATM   17  N   UNL     1      -3.907  -0.378   0.153  1.00  0.00           N  
HETATM   18  C   UNL     1      -5.086  -0.992  -0.087  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.599  -0.569  -1.226  1.00  0.00           N  
HETATM   20  C   UNL     1      -4.791   0.332  -1.770  1.00  0.00           C  
HETATM   21  S   UNL     1      -5.350  -2.081   1.285  1.00  0.00           S  
HETATM   22  C   UNL     1      -3.841  -1.635   2.101  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.270  -0.735   1.315  1.00  0.00           C  
HETATM   24  C   UNL     1       0.675   1.891   0.545  1.00  0.00           C  
HETATM   25  O   UNL     1       1.169   0.541   0.486  1.00  0.00           O  
HETATM   26  C   UNL     1      -0.358   2.117  -0.562  1.00  0.00           C  
HETATM   27  N   UNL     1      -1.548   1.307  -0.292  1.00  0.00           N  
HETATM   28  H   UNL     1       5.174  -4.047  -2.060  1.00  0.00           H  
HETATM   29  H   UNL     1       5.783  -4.390  -0.532  1.00  0.00           H  
HETATM   30  H   UNL     1       5.277  -3.039   1.425  1.00  0.00           H  
HETATM   31  H   UNL     1       4.080  -1.084   2.285  1.00  0.00           H  
HETATM   32  H   UNL     1       2.643   0.653   1.967  1.00  0.00           H  
HETATM   33  H   UNL     1       3.334   1.696  -0.837  1.00  0.00           H  
HETATM   34  H   UNL     1       4.590   3.196   0.532  1.00  0.00           H  
HETATM   35  H   UNL     1       1.754   3.415  -0.573  1.00  0.00           H  
HETATM   36  H   UNL     1       2.817   4.268   1.414  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.955   0.853  -2.702  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.467  -2.016   3.039  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.322  -0.292   1.584  1.00  0.00           H  
HETATM   40  H   UNL     1       0.223   2.075   1.519  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.635   3.171  -0.590  1.00  0.00           H  
HETATM   42  H   UNL     1       0.069   1.828  -1.522  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.582   0.743   0.496  1.00  0.00           H  
CONECT    1    9    8    2                                            
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5    5                                            
CONECT    5    4    4    7    6                                       
CONECT    6    5   28   29                                            
CONECT    7    5    8    8   30                                       
CONECT    8    1    7    7   31                                       
CONECT    9    1   25   10   32                                       
CONECT   10    9   12   11   33                                       
CONECT   11   10   34                                                 
CONECT   12   10   24   13   35                                       
CONECT   13   12   36                                                 
CONECT   14   16   15   15   27                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   20   20                                       
CONECT   17   16   23   18                                            
CONECT   18   17   21   19   19                                       
CONECT   19   18   18   20                                            
CONECT   20   16   16   19   37                                       
CONECT   21   18   22                                                 
CONECT   22   21   23   23   38                                       
CONECT   23   17   22   22   39                                       
CONECT   24   12   26   25   40                                       
CONECT   25    9   24                                                 
CONECT   26   24   27   41   42                                       
CONECT   27   14   26   43                                            
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   20                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   24                                                      
CONECT   41   26                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
