COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.503   1.528   0.049  1.00  0.00           C  
HETATM    2  C   UNL     1       3.154  -0.176   0.035  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.403   0.433   0.072  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.055   1.029  -0.071  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.597  -0.273  -0.038  1.00  0.00           C  
HETATM    6  C   UNL     1       2.126   3.094   1.121  1.00  0.00           C  
HETATM    7  C   UNL     1       2.048   2.107  -0.046  1.00  0.00           C  
HETATM    8  C   UNL     1       2.075   2.877  -1.368  1.00  0.00           C  
HETATM    9  N   UNL     1       3.192   1.193   0.010  1.00  0.00           N  
HETATM   10  N   UNL     1       5.194   0.420   0.088  1.00  0.00           N  
HETATM   11  N   UNL     1       4.402  -0.593   0.077  1.00  0.00           N  
HETATM   12  C   UNL     1       1.947  -1.022   0.010  1.00  0.00           C  
HETATM   13  N   UNL     1       0.724  -0.584   0.054  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.223  -1.509   0.021  1.00  0.00           C  
HETATM   15  C   UNL     1       0.230  -2.793  -0.055  1.00  0.00           C  
HETATM   16  S   UNL     1       1.939  -2.779  -0.091  1.00  0.00           S  
HETATM   17  C   UNL     1      -1.658  -1.176   0.063  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.489  -2.064   0.031  1.00  0.00           O  
HETATM   19  N   UNL     1      -2.049   0.111   0.138  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.793   1.767   0.043  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.141   2.073  -0.029  1.00  0.00           C  
HETATM   22  N   UNL     1      -4.305  -0.534   0.031  1.00  0.00           N  
HETATM   23  H   UNL     1       4.906   2.531   0.043  1.00  0.00           H  
HETATM   24  H   UNL     1      -7.114   1.233  -0.127  1.00  0.00           H  
HETATM   25  H   UNL     1      -6.305  -1.088  -0.070  1.00  0.00           H  
HETATM   26  H   UNL     1       3.052   3.665   1.052  1.00  0.00           H  
HETATM   27  H   UNL     1       1.275   3.773   1.079  1.00  0.00           H  
HETATM   28  H   UNL     1       2.107   2.545   2.062  1.00  0.00           H  
HETATM   29  H   UNL     1       1.122   1.535   0.023  1.00  0.00           H  
HETATM   30  H   UNL     1       3.000   3.448  -1.437  1.00  0.00           H  
HETATM   31  H   UNL     1       2.019   2.174  -2.199  1.00  0.00           H  
HETATM   32  H   UNL     1       1.224   3.556  -1.410  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.391  -3.676  -0.091  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.388   0.814   0.239  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.055   2.555   0.077  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.473   3.100  -0.053  1.00  0.00           H  
CONECT    1   10   10    9   23                                       
CONECT    2   11   11   12    9                                       
CONECT    3   19   22   22   20                                       
CONECT    4    5    5   21   24                                       
CONECT    5   22    4    4   25                                       
CONECT    6    7   26   27   28                                       
CONECT    7    9    8    6   29                                       
CONECT    8    7   30   31   32                                       
CONECT    9    1    2    7                                            
CONECT   10   11    1    1                                            
CONECT   11   10    2    2                                            
CONECT   12   16    2   13   13                                       
CONECT   13   12   12   14                                            
CONECT   14   15   15   13   17                                       
CONECT   15   16   14   14   33                                       
CONECT   16   12   15                                                 
CONECT   17   14   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17    3   34                                            
CONECT   20    3   21   21   35                                       
CONECT   21   20   20    4   36                                       
CONECT   22    3    3    5                                            
CONECT   23    1                                                      
CONECT   24    4                                                      
CONECT   25    5                                                      
CONECT   26    6                                                      
CONECT   27    6                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33   15                                                      
CONECT   34   19                                                      
CONECT   35   20                                                      
CONECT   36   21                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
