COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.349  -0.254  -3.046  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.292   0.714   2.016  1.00  0.00           C  
HETATM    3  C   UNL     1       0.402   0.404   3.316  1.00  0.00           C  
HETATM    4  C   UNL     1       1.447  -0.499   3.343  1.00  0.00           C  
HETATM    5  C   UNL     1       2.085  -0.784   4.536  1.00  0.00           C  
HETATM    6  C   UNL     1       1.677  -0.164   5.702  1.00  0.00           C  
HETATM    7  C   UNL     1       0.629   0.735   5.677  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.006   1.023   4.483  1.00  0.00           C  
HETATM    9  C   UNL     1       2.373  -0.474   7.003  1.00  0.00           C  
HETATM   10  O   UNL     1       2.040   1.356  -4.062  1.00  0.00           O  
HETATM   11  O   UNL     1       2.140  -1.097  -4.648  1.00  0.00           O  
HETATM   12  N   UNL     1       0.504   0.391  -5.720  1.00  0.00           N  
HETATM   13  S   UNL     1       1.439   0.109  -4.382  1.00  0.00           S  
HETATM   14  C   UNL     1      -0.136  -1.454  -2.643  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.983  -1.502  -1.552  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.310  -0.346  -0.923  1.00  0.00           C  
HETATM   17  S   UNL     1      -0.400   0.861  -1.871  1.00  0.00           S  
HETATM   18  S   UNL     1      -2.358  -0.101   0.472  1.00  0.00           S  
HETATM   19  O   UNL     1      -3.220  -1.230   0.511  1.00  0.00           O  
HETATM   20  O   UNL     1      -2.779   1.253   0.405  1.00  0.00           O  
HETATM   21  N   UNL     1      -1.411  -0.211   1.826  1.00  0.00           N  
HETATM   22  H   UNL     1      -0.667   1.737   2.039  1.00  0.00           H  
HETATM   23  H   UNL     1       0.412   0.605   1.192  1.00  0.00           H  
HETATM   24  H   UNL     1       1.766  -0.983   2.432  1.00  0.00           H  
HETATM   25  H   UNL     1       2.902  -1.490   4.557  1.00  0.00           H  
HETATM   26  H   UNL     1       0.309   1.219   6.588  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.823   1.729   4.462  1.00  0.00           H  
HETATM   28  H   UNL     1       3.205   0.215   7.143  1.00  0.00           H  
HETATM   29  H   UNL     1       1.668  -0.364   7.827  1.00  0.00           H  
HETATM   30  H   UNL     1       2.748  -1.497   6.980  1.00  0.00           H  
HETATM   31  H   UNL     1       0.923   0.610  -6.567  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.462   0.336  -5.656  1.00  0.00           H  
HETATM   33  H   UNL     1       0.137  -2.359  -3.165  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.384  -2.444  -1.210  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.598  -0.889   2.495  1.00  0.00           H  
CONECT    1   13   14   14   17                                       
CONECT    2    3   21   22   23                                       
CONECT    3    2    4    4    8                                       
CONECT    4    3    3    5   24                                       
CONECT    5    4    6    6   25                                       
CONECT    6    5    5    7    9                                       
CONECT    7    6    8    8   26                                       
CONECT    8    3    7    7   27                                       
CONECT    9    6   28   29   30                                       
CONECT   10   13   13                                                 
CONECT   11   13   13                                                 
CONECT   12   13   31   32                                            
CONECT   13    1   10   10   11                                       
CONECT   13   11   12                                                 
CONECT   14    1    1   15   33                                       
CONECT   15   14   16   16   34                                       
CONECT   16   15   15   17   18                                       
CONECT   17    1   16                                                 
CONECT   18   16   19   19   20                                       
CONECT   18   20   21                                                 
CONECT   19   18   18                                                 
CONECT   20   18   18                                                 
CONECT   21    2   18   35                                            
CONECT   22    2                                                      
CONECT   23    2                                                      
CONECT   24    4                                                      
CONECT   25    5                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   21                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
