COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.051  -0.729  -0.467  1.00  0.00           C  
HETATM    2  C   UNL     1       2.559   0.443   0.097  1.00  0.00           C  
HETATM    3  C   UNL     1       3.944   0.484   0.399  1.00  0.00           C  
HETATM    4  N   UNL     1       4.691  -0.578   0.137  1.00  0.00           N  
HETATM    5  N   UNL     1       2.882  -1.755  -0.698  1.00  0.00           N  
HETATM    6  C   UNL     1       1.812   2.807   0.870  1.00  0.00           C  
HETATM    7  C   UNL     1       1.528   1.450   0.280  1.00  0.00           C  
HETATM    8  N   UNL     1       4.507   1.617   0.959  1.00  0.00           N  
HETATM    9  C   UNL     1       4.165  -1.671  -0.400  1.00  0.00           C  
HETATM   10  N   UNL     1       4.987  -2.757  -0.657  1.00  0.00           N  
HETATM   11  S   UNL     1       0.325  -0.556  -0.747  1.00  0.00           S  
HETATM   12  C   UNL     1       0.317   1.079  -0.115  1.00  0.00           C  
HETATM   13  S   UNL     1      -1.118   2.098  -0.011  1.00  0.00           S  
HETATM   14  C   UNL     1      -2.410   1.017  -0.527  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.894   0.017   0.346  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.366  -0.142   1.635  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.858  -1.116   2.450  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.879  -1.961   2.022  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.415  -1.836   0.776  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.933  -0.841  -0.091  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.464  -0.683  -1.383  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.978   0.290  -2.204  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.962   1.142  -1.785  1.00  0.00           C  
HETATM   24  H   UNL     1       1.809   2.738   1.958  1.00  0.00           H  
HETATM   25  H   UNL     1       2.789   3.154   0.531  1.00  0.00           H  
HETATM   26  H   UNL     1       1.045   3.511   0.549  1.00  0.00           H  
HETATM   27  H   UNL     1       3.964   2.407   1.106  1.00  0.00           H  
HETATM   28  H   UNL     1       5.446   1.622   1.205  1.00  0.00           H  
HETATM   29  H   UNL     1       5.932  -2.711  -0.444  1.00  0.00           H  
HETATM   30  H   UNL     1       4.617  -3.563  -1.049  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.573   0.506   1.980  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.449  -1.236   3.443  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.251  -2.726   2.687  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.207  -2.497   0.458  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.256  -1.332  -1.725  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.392   0.404  -3.195  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.595   1.905  -2.455  1.00  0.00           H  
CONECT    1    2   11    5    5                                       
CONECT    2    7    3    3    1                                       
CONECT    3    8    2    2    4                                       
CONECT    4    3    9    9                                            
CONECT    5    1    1    9                                            
CONECT    6    7   24   25   26                                       
CONECT    7    6   12   12    2                                       
CONECT    8    3   27   28                                            
CONECT    9    4    4    5   10                                       
CONECT   10    9   29   30                                            
CONECT   11   12    1                                                 
CONECT   12   13    7    7   11                                       
CONECT   13   14   12                                                 
CONECT   14   23   23   15   13                                       
CONECT   15   20   14   16   16                                       
CONECT   16   15   15   17   31                                       
CONECT   17   18   18   16   32                                       
CONECT   18   19   17   17   33                                       
CONECT   19   20   20   18   34                                       
CONECT   20   21   19   19   15                                       
CONECT   21   22   22   20   35                                       
CONECT   22   21   21   23   36                                       
CONECT   23   22   14   14   37                                       
CONECT   24    6                                                      
CONECT   25    6                                                      
CONECT   26    6                                                      
CONECT   27    8                                                      
CONECT   28    8                                                      
CONECT   29   10                                                      
CONECT   30   10                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   18                                                      
CONECT   34   19                                                      
CONECT   35   21                                                      
CONECT   36   22                                                      
CONECT   37   23                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
