COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.388   1.536   0.148  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.610   0.990   0.482  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.004  -0.228  -0.076  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.312  -0.817   0.277  1.00  0.00           C  
HETATM    5  O   UNL     1      -6.688  -1.993  -0.263  1.00  0.00           O  
HETATM    6  O   UNL     1      -7.047  -0.242   1.054  1.00  0.00           O  
HETATM    7  C   UNL     1      -4.156  -0.886  -0.969  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.936  -0.329  -1.294  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.553   0.878  -0.738  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.222   1.483  -1.103  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.152   0.990  -0.126  1.00  0.00           C  
HETATM   12  N   UNL     1       1.142   1.578  -0.481  1.00  0.00           N  
HETATM   13  S   UNL     1       2.390   1.551   0.607  1.00  0.00           S  
HETATM   14  O   UNL     1       3.500   2.157  -0.041  1.00  0.00           O  
HETATM   15  O   UNL     1       1.859   2.019   1.839  1.00  0.00           O  
HETATM   16  C   UNL     1       2.823  -0.138   0.861  1.00  0.00           C  
HETATM   17  C   UNL     1       2.689  -0.779   2.069  1.00  0.00           C  
HETATM   18  C   UNL     1       3.069  -2.062   2.076  1.00  0.00           C  
HETATM   19  S   UNL     1       3.625  -2.543   0.537  1.00  0.00           S  
HETATM   20  C   UNL     1       3.322  -0.943  -0.126  1.00  0.00           C  
HETATM   21  C   UNL     1       3.565  -0.537  -1.511  1.00  0.00           C  
HETATM   22  O   UNL     1       4.169  -1.387  -2.367  1.00  0.00           O  
HETATM   23  O   UNL     1       3.223   0.566  -1.891  1.00  0.00           O  
HETATM   24  H   UNL     1      -3.084   2.480   0.575  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.261   1.504   1.174  1.00  0.00           H  
HETATM   26  H   UNL     1      -7.552  -2.339  -0.002  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.454  -1.828  -1.404  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.280  -0.837  -1.985  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.953   1.184  -2.117  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.289   2.569  -1.051  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.421   1.289   0.887  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.084  -0.096  -0.179  1.00  0.00           H  
HETATM   33  H   UNL     1       1.267   1.984  -1.354  1.00  0.00           H  
HETATM   34  H   UNL     1       2.306  -0.283   2.948  1.00  0.00           H  
HETATM   35  H   UNL     1       3.029  -2.707   2.942  1.00  0.00           H  
HETATM   36  H   UNL     1       4.309  -1.075  -3.271  1.00  0.00           H  
CONECT    1    2    9    9   24                                       
CONECT    2    3    3    1   25                                       
CONECT    3    4    2    2    7                                       
CONECT    4    6    6    5    3                                       
CONECT    5    4   26                                                 
CONECT    6    4    4                                                 
CONECT    7    3    8    8   27                                       
CONECT    8    7    7    9   28                                       
CONECT    9    1    1    8   10                                       
CONECT   10    9   11   29   30                                       
CONECT   11   10   12   31   32                                       
CONECT   12   11   13   33                                            
CONECT   13   14   14   15   15                                       
CONECT   13   12   16                                                 
CONECT   14   13   13                                                 
CONECT   15   13   13                                                 
CONECT   16   13   17   20   20                                       
CONECT   17   16   18   18   34                                       
CONECT   18   17   17   19   35                                       
CONECT   19   18   20                                                 
CONECT   20   16   16   21   19                                       
CONECT   21   23   23   20   22                                       
CONECT   22   21   36                                                 
CONECT   23   21   21                                                 
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    5                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29   10                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   22                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
