COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.931   0.161   0.482  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.266  -0.538   0.025  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.574   0.161   0.028  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.014   1.469   0.041  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.882   2.127  -0.407  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.663   1.480  -0.416  1.00  0.00           C  
HETATM    7  C   UNL     1       2.218  -1.250  -0.439  1.00  0.00           C  
HETATM    8  C   UNL     1       3.572  -0.758  -0.962  1.00  0.00           C  
HETATM    9  C   UNL     1       1.575   0.990   0.233  1.00  0.00           C  
HETATM   10  C   UNL     1       5.105   0.665   0.318  1.00  0.00           C  
HETATM   11  O   UNL     1       5.958  -0.195   0.218  1.00  0.00           O  
HETATM   12  N   UNL     1       5.357   1.785   1.025  1.00  0.00           N  
HETATM   13  N   UNL     1       3.908   0.500  -0.278  1.00  0.00           N  
HETATM   14  C   UNL     1       2.902   1.573  -0.262  1.00  0.00           C  
HETATM   15  N   UNL     1       1.222  -0.180  -0.583  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.048  -0.638  -0.273  1.00  0.00           C  
HETATM   17  S   UNL     1      -0.443  -2.279   0.227  1.00  0.00           S  
HETATM   18  C   UNL     1      -2.143  -1.835   0.354  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.130   0.075  -0.307  1.00  0.00           N  
HETATM   20  C   UNL     1      -4.716  -0.494   0.483  1.00  0.00           C  
HETATM   21  H   UNL     1      -6.818  -0.348   0.831  1.00  0.00           H  
HETATM   22  H   UNL     1      -6.966   1.980   0.046  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.953   3.148  -0.750  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.780   1.994  -0.765  1.00  0.00           H  
HETATM   25  H   UNL     1       1.901  -2.121  -1.012  1.00  0.00           H  
HETATM   26  H   UNL     1       2.311  -1.521   0.613  1.00  0.00           H  
HETATM   27  H   UNL     1       4.338  -1.504  -0.753  1.00  0.00           H  
HETATM   28  H   UNL     1       3.508  -0.585  -2.036  1.00  0.00           H  
HETATM   29  H   UNL     1       1.677   0.688   1.276  1.00  0.00           H  
HETATM   30  H   UNL     1       0.791   1.743   0.148  1.00  0.00           H  
HETATM   31  H   UNL     1       6.190   1.872   1.514  1.00  0.00           H  
HETATM   32  H   UNL     1       4.706   2.503   1.044  1.00  0.00           H  
HETATM   33  H   UNL     1       2.774   1.970  -1.269  1.00  0.00           H  
HETATM   34  H   UNL     1       3.226   2.369   0.409  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.948  -2.493   0.645  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.653  -1.516   0.828  1.00  0.00           H  
CONECT    1    4    4   20   21                                       
CONECT    2   18   18    3   19                                       
CONECT    3    6    2   20   20                                       
CONECT    4    5    1    1   22                                       
CONECT    5    6    6    4   23                                       
CONECT    6    5    5    3   24                                       
CONECT    7   15    8   25   26                                       
CONECT    8    7   13   27   28                                       
CONECT    9   15   14   29   30                                       
CONECT   10   12   13   11   11                                       
CONECT   11   10   10                                                 
CONECT   12   10   31   32                                            
CONECT   13    8   14   10                                            
CONECT   14   13    9   33   34                                       
CONECT   15   16    7    9                                            
CONECT   16   17   19   19   15                                       
CONECT   17   18   16                                                 
CONECT   18   17    2    2   35                                       
CONECT   19    2   16   16                                            
CONECT   20    3    3    1   36                                       
CONECT   21    1                                                      
CONECT   22    4                                                      
CONECT   23    5                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   18                                                      
CONECT   36   20                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
