COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.008   0.093   3.315  1.00  0.00           C  
HETATM    2  O   UNL     1      -3.078   0.204   0.486  1.00  0.00           O  
HETATM    3  C   UNL     1      -1.514   0.101  -1.329  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.877  -0.432   0.047  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.216  -1.374  -2.997  1.00  0.00           C  
HETATM    6  C   UNL     1       0.004  -0.547  -4.237  1.00  0.00           C  
HETATM    7  C   UNL     1       1.171  -0.178  -4.820  1.00  0.00           C  
HETATM    8  C   UNL     1       1.132   0.588  -5.969  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.070   0.956  -6.474  1.00  0.00           C  
HETATM   10  O   UNL     1      -1.378   0.635   5.392  1.00  0.00           O  
HETATM   11  O   UNL     1       1.129   0.929   5.434  1.00  0.00           O  
HETATM   12  N   UNL     1       0.114  -1.294   5.692  1.00  0.00           N  
HETATM   13  S   UNL     1      -0.054   0.231   5.071  1.00  0.00           S  
HETATM   14  C   UNL     1      -1.029  -0.101   2.448  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.784  -0.185   1.075  1.00  0.00           C  
HETATM   16  C   UNL     1       0.519  -0.054   0.702  1.00  0.00           C  
HETATM   17  S   UNL     1       1.399   0.165   2.215  1.00  0.00           S  
HETATM   18  S   UNL     1       1.112  -0.095  -0.948  1.00  0.00           S  
HETATM   19  O   UNL     1       1.433   1.245  -1.293  1.00  0.00           O  
HETATM   20  O   UNL     1       1.985  -1.213  -1.034  1.00  0.00           O  
HETATM   21  N   UNL     1      -0.260  -0.496  -1.825  1.00  0.00           N  
HETATM   22  S   UNL     1      -1.202   0.206  -5.315  1.00  0.00           S  
HETATM   23  H   UNL     1      -3.308  -0.188   1.339  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.319  -0.130  -2.025  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.394   1.183  -1.271  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.055  -1.505  -0.027  1.00  0.00           H  
HETATM   27  H   UNL     1       0.599  -2.088  -2.885  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.160  -1.912  -3.082  1.00  0.00           H  
HETATM   29  H   UNL     1       2.116  -0.485  -4.397  1.00  0.00           H  
HETATM   30  H   UNL     1       2.047   0.891  -6.456  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.287   1.550  -7.350  1.00  0.00           H  
HETATM   32  H   UNL     1       0.113  -1.429   6.653  1.00  0.00           H  
HETATM   33  H   UNL     1       0.208  -2.053   5.095  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.040  -0.184   2.819  1.00  0.00           H  
CONECT    1   13   14   14   17                                       
CONECT    2    4   23                                                 
CONECT    3    4   21   24   25                                       
CONECT    4    2    3   15   26                                       
CONECT    5    6   21   27   28                                       
CONECT    6    5    7    7   22                                       
CONECT    7    6    6    8   29                                       
CONECT    8    7    9    9   30                                       
CONECT    9    8    8   22   31                                       
CONECT   10   13   13                                                 
CONECT   11   13   13                                                 
CONECT   12   13   32   33                                            
CONECT   13    1   10   10   11                                       
CONECT   13   11   12                                                 
CONECT   14    1    1   15   34                                       
CONECT   15    4   14   16   16                                       
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    3    5   18                                            
CONECT   22    6    9                                                 
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   14                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
