COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.959   2.809   0.657  1.00  0.00           C  
HETATM    2  C   UNL     1       1.157   2.914  -0.496  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.325  -0.228   0.766  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.335  -1.155   0.588  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.392   0.998   0.130  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.412  -0.856  -0.225  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.470   1.297  -0.683  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.480   0.370  -0.860  1.00  0.00           C  
HETATM    9  N   UNL     1       0.952  -0.566   0.190  1.00  0.00           N  
HETATM   10  N   UNL     1       1.195   0.813   0.146  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.067  -1.204   0.841  1.00  0.00           C  
HETATM   12  C   UNL     1       1.679  -1.551  -0.414  1.00  0.00           C  
HETATM   13  C   UNL     1       1.965   1.512   1.028  1.00  0.00           C  
HETATM   14  C   UNL     1       0.698   1.679  -0.783  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.153  -0.551   1.657  1.00  0.00           C  
HETATM   16  N   UNL     1       0.074  -2.481   0.626  1.00  0.00           N  
HETATM   17  N   UNL     1       1.104  -2.692  -0.114  1.00  0.00           N  
HETATM   18  S   UNL     1       3.118  -1.332  -1.407  1.00  0.00           S  
HETATM   19  C   UNL     1       2.700   0.935   2.210  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.201   1.316  -1.936  1.00  0.00           C  
HETATM   21  H   UNL     1       2.478   3.617   1.151  1.00  0.00           H  
HETATM   22  H   UNL     1       0.947   3.818  -1.049  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.282  -2.112   1.084  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.603   1.722   0.269  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.201  -1.580  -0.364  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.523   2.255  -1.179  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.321   0.603  -1.496  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.771   0.367   2.102  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.474  -1.231   2.446  1.00  0.00           H  
HETATM   30  H   UNL     1       4.115  -1.406  -0.413  1.00  0.00           H  
HETATM   31  H   UNL     1       3.702   0.635   1.904  1.00  0.00           H  
HETATM   32  H   UNL     1       2.771   1.686   2.997  1.00  0.00           H  
HETATM   33  H   UNL     1       2.159   0.066   2.586  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.242   1.390  -1.623  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.021   2.000  -2.766  1.00  0.00           H  
HETATM   36  H   UNL     1       0.011   0.295  -2.255  1.00  0.00           H  
CONECT    1   13   13    2   21                                       
CONECT    2   14   14    1   22                                       
CONECT    3   15    4    4    5                                       
CONECT    4    3    3    6   23                                       
CONECT    5    3    7    7   24                                       
CONECT    6    4    8    8   25                                       
CONECT    7    5    5    8   26                                       
CONECT    8    6    6    7   27                                       
CONECT    9   10   11   12                                            
CONECT   10    9   13   14                                            
CONECT   11    9   15   16   16                                       
CONECT   12    9   17   17   18                                       
CONECT   13   10    1    1   19                                       
CONECT   14   10    2    2   20                                       
CONECT   15   11    3   28   29                                       
CONECT   16   11   11   17                                            
CONECT   17   12   12   16                                            
CONECT   18   12   30                                                 
CONECT   19   13   31   32   33                                       
CONECT   20   14   34   35   36                                       
CONECT   21    1                                                      
CONECT   22    2                                                      
CONECT   23    4                                                      
CONECT   24    5                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28   15                                                      
CONECT   29   15                                                      
CONECT   30   18                                                      
CONECT   31   19                                                      
CONECT   32   19                                                      
CONECT   33   19                                                      
CONECT   34   20                                                      
CONECT   35   20                                                      
CONECT   36   20                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
