COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.432  -0.332   0.055  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.598   3.220   0.019  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.808   2.579   0.207  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.869   1.198   0.239  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.713   0.449   0.081  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.495   1.097  -0.106  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.440   2.481  -0.138  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.320   0.342  -0.261  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.463  -1.100  -0.530  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.580  -1.632   0.379  1.00  0.00           C  
HETATM   11  O   UNL     1      -3.782  -0.908   0.105  1.00  0.00           O  
HETATM   12  C   UNL     1      -2.799  -3.097   0.105  1.00  0.00           C  
HETATM   13  O   UNL     1      -3.853  -3.476  -0.361  1.00  0.00           O  
HETATM   14  N   UNL     1      -1.824  -3.987   0.378  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.104   0.916  -0.168  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.010   2.116  -0.023  1.00  0.00           O  
HETATM   17  C   UNL     1       1.138   0.066  -0.244  1.00  0.00           C  
HETATM   18  S   UNL     1       2.598   1.100   0.059  1.00  0.00           S  
HETATM   19  C   UNL     1       3.969  -0.080  -0.071  1.00  0.00           C  
HETATM   20  C   UNL     1       5.293   0.649   0.163  1.00  0.00           C  
HETATM   21  O   UNL     1       6.208  -1.495  -0.186  1.00  0.00           O  
HETATM   22  O   UNL     1       7.697   0.087   0.220  1.00  0.00           O  
HETATM   23  H   UNL     1      -3.558   4.299  -0.010  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.711   3.159   0.331  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.817   0.702   0.386  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.495   2.982  -0.289  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.731  -1.256  -1.575  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.528  -1.612  -0.308  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.298  -1.494   1.423  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.982  -3.684   0.751  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.965  -4.931   0.201  1.00  0.00           H  
HETATM   32  H   UNL     1       1.088  -0.720   0.509  1.00  0.00           H  
HETATM   33  H   UNL     1       1.211  -0.384  -1.234  1.00  0.00           H  
HETATM   34  H   UNL     1       3.847  -0.863   0.678  1.00  0.00           H  
HETATM   35  H   UNL     1       3.971  -0.526  -1.066  1.00  0.00           H  
HETATM   36  H   UNL     1       5.292   1.095   1.158  1.00  0.00           H  
HETATM   37  H   UNL     1       5.415   1.431  -0.586  1.00  0.00           H  
HETATM   38  H   UNL     1       8.394  -0.578   0.137  1.00  0.00           H  
CONECT    1   20   21   21   22                                       
CONECT    2    3    3    7   23                                       
CONECT    3    2    2    4   24                                       
CONECT    4    3    5    5   25                                       
CONECT    5    4    4    6   11                                       
CONECT    6    7    7    5    8                                       
CONECT    7    2    6    6   26                                       
CONECT    8    6   15    9                                            
CONECT    9    8   10   27   28                                       
CONECT   10   11    9   12   29                                       
CONECT   11    5   10                                                 
CONECT   12   10   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   30   31                                            
CONECT   15   16   16    8   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   32   33                                       
CONECT   18   17   19                                                 
CONECT   19   18   20   34   35                                       
CONECT   20   19    1   36   37                                       
CONECT   21    1    1                                                 
CONECT   22    1   38                                                 
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    7                                                      
CONECT   27    9                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   14                                                      
CONECT   31   14                                                      
CONECT   32   17                                                      
CONECT   33   17                                                      
CONECT   34   19                                                      
CONECT   35   19                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
CONECT   38   22                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
