COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.555  -1.764  -0.336  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.860   0.601   0.128  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.014  -0.487  -0.089  1.00  0.00           C  
HETATM    4  C   UNL     1       1.446  -0.300  -0.059  1.00  0.00           C  
HETATM    5  C   UNL     1       2.335  -1.073   0.609  1.00  0.00           C  
HETATM    6  C   UNL     1       3.814   0.342  -0.273  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.148  -1.359  -0.238  1.00  0.00           C  
HETATM    8  C   UNL     1       6.164   0.303   0.014  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.824  -3.076  -0.582  1.00  0.00           C  
HETATM   10  C   UNL     1       1.924  -2.261   1.440  1.00  0.00           C  
HETATM   11  C   UNL     1       7.528   0.880  -0.262  1.00  0.00           C  
HETATM   12  N   UNL     1       5.069   0.873  -0.527  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.773  -0.818  -0.140  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.925  -1.929  -0.362  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.235   0.433   0.102  1.00  0.00           C  
HETATM   16  N   UNL     1       3.585  -0.699   0.471  1.00  0.00           N  
HETATM   17  N   UNL     1      -4.062  -2.676  -0.497  1.00  0.00           N  
HETATM   18  N   UNL     1      -4.133   2.075  -1.028  1.00  0.00           N  
HETATM   19  O   UNL     1      -5.176  -0.723  -0.108  1.00  0.00           O  
HETATM   20  O   UNL     1       6.051  -0.674   0.723  1.00  0.00           O  
HETATM   21  O   UNL     1      -4.254   1.395   1.342  1.00  0.00           O  
HETATM   22  O   UNL     1      -2.452   2.939   0.559  1.00  0.00           O  
HETATM   23  S   UNL     1       2.347   0.963  -0.893  1.00  0.00           S  
HETATM   24  S   UNL     1      -3.297   1.812   0.377  1.00  0.00           S  
HETATM   25  H   UNL     1       0.097  -2.607  -0.509  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.441   1.578   0.317  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.508  -4.089  -0.782  1.00  0.00           H  
HETATM   28  H   UNL     1       1.825  -3.137   0.799  1.00  0.00           H  
HETATM   29  H   UNL     1       2.681  -2.452   2.201  1.00  0.00           H  
HETATM   30  H   UNL     1       0.968  -2.054   1.922  1.00  0.00           H  
HETATM   31  H   UNL     1       7.948   0.411  -1.152  1.00  0.00           H  
HETATM   32  H   UNL     1       7.442   1.955  -0.423  1.00  0.00           H  
HETATM   33  H   UNL     1       8.181   0.692   0.590  1.00  0.00           H  
HETATM   34  H   UNL     1       5.159   1.655  -1.094  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.979   1.505  -1.798  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.777   2.799  -1.081  1.00  0.00           H  
CONECT    1   14   14    3   25                                       
CONECT    2    3    3   15   26                                       
CONECT    3    4    1    2    2                                       
CONECT    4    5    5   23    3                                       
CONECT    5   10   16    4    4                                       
CONECT    6   16   16   12   23                                       
CONECT    7   17   13   19   19                                       
CONECT    8   12   11   20   20                                       
CONECT    9   14   17   17   27                                       
CONECT   10    5   28   29   30                                       
CONECT   11    8   31   32   33                                       
CONECT   12    6    8   34                                            
CONECT   13   14    7   15   15                                       
CONECT   14    1    1    9   13                                       
CONECT   15   13   13    2   24                                       
CONECT   16    5    6    6                                            
CONECT   17    9    9    7                                            
CONECT   18   24   35   36                                            
CONECT   19    7    7                                                 
CONECT   20    8    8                                                 
CONECT   21   24   24                                                 
CONECT   22   24   24                                                 
CONECT   23    6    4                                                 
CONECT   24   15   21   21   18                                       
CONECT   24   22   22                                                 
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    9                                                      
CONECT   28   10                                                      
CONECT   29   10                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   18                                                      
CONECT   36   18                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
