COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.046  -0.067  -0.666  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.152   0.061   0.383  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.008   1.291   0.074  1.00  0.00           C  
HETATM    4  C   UNL     1       0.607  -2.667  -0.903  1.00  0.00           C  
HETATM    5  C   UNL     1       1.212  -2.573   0.501  1.00  0.00           C  
HETATM    6  C   UNL     1       2.340   1.092   0.169  1.00  0.00           C  
HETATM    7  C   UNL     1       1.387  -0.105   0.172  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.104  -1.352  -1.234  1.00  0.00           C  
HETATM    9  C   UNL     1       2.158  -1.370   0.558  1.00  0.00           C  
HETATM   10  O   UNL     1       0.555   2.910   0.959  1.00  0.00           O  
HETATM   11  S   UNL     1       1.401   2.612  -0.143  1.00  0.00           S  
HETATM   12  O   UNL     1       2.447   3.717  -0.123  1.00  0.00           O  
HETATM   13  O   UNL     1       0.902   2.626  -1.474  1.00  0.00           O  
HETATM   14  O   UNL     1       0.825  -0.271  -1.133  1.00  0.00           O  
HETATM   15  O   UNL     1      -1.178  -1.145  -0.314  1.00  0.00           O  
HETATM   16  O   UNL     1      -3.972  -1.109   0.356  1.00  0.00           O  
HETATM   17  O   UNL     1      -4.967   1.478   1.117  1.00  0.00           O  
HETATM   18  O   UNL     1      -0.333  -3.742  -0.947  1.00  0.00           O  
HETATM   19  O   UNL     1       1.940  -3.769   0.789  1.00  0.00           O  
HETATM   20  O   UNL     1       2.672  -1.230   1.884  1.00  0.00           O  
HETATM   21  H   UNL     1      -2.492  -0.263  -1.642  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.475   0.861  -0.708  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.705   0.169   1.371  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.369   2.171   0.007  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.526   1.145  -0.874  1.00  0.00           H  
HETATM   26  H   UNL     1       1.399  -2.845  -1.630  1.00  0.00           H  
HETATM   27  H   UNL     1       0.414  -2.447   1.234  1.00  0.00           H  
HETATM   28  H   UNL     1       2.837   1.164   1.136  1.00  0.00           H  
HETATM   29  H   UNL     1       3.087   0.959  -0.614  1.00  0.00           H  
HETATM   30  H   UNL     1       0.589   0.068   0.894  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.499  -1.397  -2.249  1.00  0.00           H  
HETATM   32  H   UNL     1       2.983  -1.521  -0.139  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.403  -1.267  -0.495  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.546   2.242   0.987  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.758  -3.858  -1.809  1.00  0.00           H  
HETATM   36  H   UNL     1       1.402  -4.572   0.763  1.00  0.00           H  
HETATM   37  H   UNL     1       3.173  -1.997   2.195  1.00  0.00           H  
HETATM   38  H   UNL     1       2.089   4.601  -0.278  1.00  0.00           H  
CONECT    1    2   15   21   22                                       
CONECT    2    3    1   16   23                                       
CONECT    3   17    2   24   25                                       
CONECT    4    5    8   18   26                                       
CONECT    5    9   19    4   27                                       
CONECT    6   11    7   28   29                                       
CONECT    7    6    9   14   30                                       
CONECT    8   15   14    4   31                                       
CONECT    9   20    7    5   32                                       
CONECT   10   11   11                                                 
CONECT   11   10   10   13   13                                       
CONECT   11   12    6                                                 
CONECT   12   11   38                                                 
CONECT   13   11   11                                                 
CONECT   14    7    8                                                 
CONECT   15    1    8                                                 
CONECT   16    2   33                                                 
CONECT   17    3   34                                                 
CONECT   18    4   35                                                 
CONECT   19    5   36                                                 
CONECT   20    9   37                                                 
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   16                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   12                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
