COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.979  -0.105  -0.073  1.00  0.00           C  
HETATM    2  C   UNL     1       1.601  -0.602   0.092  1.00  0.00           C  
HETATM    3  N   UNL     1       5.137  -0.110  -0.667  1.00  0.00           N  
HETATM    4  C   UNL     1       4.005  -0.776  -0.643  1.00  0.00           C  
HETATM    5  C   UNL     1       0.755  -0.336   1.148  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.447  -1.000   0.905  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.656  -0.985   1.803  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.066   0.314  -0.421  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.170   0.819   0.955  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.647  -1.452   0.361  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.750  -1.035  -0.359  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.271   1.242   0.236  1.00  0.00           C  
HETATM   13  C   UNL     1       6.337   1.987  -0.097  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.416   2.132  -1.148  1.00  0.00           C  
HETATM   15  S   UNL     1       3.582   1.472   0.432  1.00  0.00           S  
HETATM   16  N   UNL     1       0.920  -1.406  -0.775  1.00  0.00           N  
HETATM   17  N   UNL     1      -0.350  -1.639  -0.234  1.00  0.00           N  
HETATM   18  C   UNL     1       5.137   1.077  -0.159  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.859  -0.527   1.019  1.00  0.00           C  
HETATM   20  C   UNL     1       3.863  -2.168  -1.203  1.00  0.00           C  
HETATM   21  O   UNL     1      -6.150   0.728  -1.129  1.00  0.00           O  
HETATM   22  H   UNL     1       0.982   0.276   2.008  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.835  -1.988   2.189  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.483  -0.301   2.635  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.550   1.541   1.467  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.400  -2.503   0.409  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.365  -1.758  -0.873  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.512   2.293   0.186  1.00  0.00           H  
HETATM   29  H   UNL     1       6.376   2.599  -0.999  1.00  0.00           H  
HETATM   30  H   UNL     1       6.258   2.633   0.777  1.00  0.00           H  
HETATM   31  H   UNL     1       7.244   1.388  -0.025  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.565   2.656  -1.583  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.306   2.325  -1.747  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.579   2.484  -0.130  1.00  0.00           H  
HETATM   35  H   UNL     1       1.258  -1.759  -1.613  1.00  0.00           H  
HETATM   36  H   UNL     1       4.080  -2.898  -0.423  1.00  0.00           H  
HETATM   37  H   UNL     1       2.844  -2.313  -1.562  1.00  0.00           H  
HETATM   38  H   UNL     1       4.561  -2.301  -2.029  1.00  0.00           H  
CONECT    1    4    4    2   15                                       
CONECT    2   16    1    5    5                                       
CONECT    3    4   18   18                                            
CONECT    4   20    3    1    1                                       
CONECT    5    2    2    6   22                                       
CONECT    6   17   17    5    7                                       
CONECT    7    6   19   23   24                                       
CONECT    8   11   11   12   21                                       
CONECT    9   19   12   12   25                                       
CONECT   10   19   19   11   26                                       
CONECT   11   10    8    8   27                                       
CONECT   12    9    9    8   28                                       
CONECT   13   18   29   30   31                                       
CONECT   14   21   32   33   34                                       
CONECT   15    1   18                                                 
CONECT   16   17    2   35                                            
CONECT   17   16    6    6                                            
CONECT   18    3    3   13   15                                       
CONECT   19    7   10   10    9                                       
CONECT   20    4   36   37   38                                       
CONECT   21    8   14                                                 
CONECT   22    5                                                      
CONECT   23    7                                                      
CONECT   24    7                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   11                                                      
CONECT   28   12                                                      
CONECT   29   13                                                      
CONECT   30   13                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   16                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
CONECT   38   20                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
