COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.044   0.018  -0.318  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.323  -1.633  -1.383  1.00  0.00           C  
HETATM    3  C   UNL     1       2.599  -0.704   0.740  1.00  0.00           C  
HETATM    4  C   UNL     1       3.969  -0.750   0.896  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.688  -0.823   1.183  1.00  0.00           C  
HETATM    6  C   UNL     1       0.623   0.071  -0.486  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.542   0.114  -0.623  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.003   0.168  -0.794  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.201  -0.121   0.096  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.489  -1.933   0.986  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.805  -2.338  -0.297  1.00  0.00           C  
HETATM   12  N   UNL     1       7.087  -1.458  -0.643  1.00  0.00           N  
HETATM   13  N   UNL     1      -2.613   0.765   0.396  1.00  0.00           N  
HETATM   14  C   UNL     1       2.880   0.692  -1.209  1.00  0.00           C  
HETATM   15  S   UNL     1       6.541  -0.149   0.212  1.00  0.00           S  
HETATM   16  O   UNL     1       6.773  -0.440   1.583  1.00  0.00           O  
HETATM   17  O   UNL     1       7.065   1.001  -0.438  1.00  0.00           O  
HETATM   18  C   UNL     1       4.792  -0.084   0.006  1.00  0.00           C  
HETATM   19  C   UNL     1       4.249   0.637  -1.042  1.00  0.00           C  
HETATM   20  S   UNL     1      -4.181   1.294   0.347  1.00  0.00           S  
HETATM   21  O   UNL     1      -4.301   2.087  -0.826  1.00  0.00           O  
HETATM   22  O   UNL     1      -4.482   1.780   1.648  1.00  0.00           O  
HETATM   23  C   UNL     1      -5.519  -0.526  -1.187  1.00  0.00           C  
HETATM   24  H   UNL     1      -6.571  -1.949  -2.386  1.00  0.00           H  
HETATM   25  H   UNL     1       1.957  -1.224   1.435  1.00  0.00           H  
HETATM   26  H   UNL     1       4.399  -1.308   1.714  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.441  -0.507   2.185  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.244   0.774  -1.668  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.390  -0.841  -0.934  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.869  -2.482   1.835  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.430  -3.206  -0.450  1.00  0.00           H  
HETATM   32  H   UNL     1       7.555  -2.174  -0.187  1.00  0.00           H  
HETATM   33  H   UNL     1       6.938  -1.509  -1.600  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.098   0.850   1.214  1.00  0.00           H  
HETATM   35  H   UNL     1       2.457   1.255  -2.028  1.00  0.00           H  
HETATM   36  H   UNL     1       4.897   1.159  -1.731  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.138   0.023  -2.036  1.00  0.00           H  
CONECT    1   14    6    3    3                                       
CONECT    2   11   11   23   24                                       
CONECT    3    1    1    4   25                                       
CONECT    4   18   18    3   26                                       
CONECT    5   10   10    9   27                                       
CONECT    6    1    7    7    7                                       
CONECT    7    6    6    6    8                                       
CONECT    8    7   13   28   29                                       
CONECT    9   20    5   23   23                                       
CONECT   10    5    5   11   30                                       
CONECT   11   10    2    2   31                                       
CONECT   12   15   32   33                                            
CONECT   13   20    8   34                                            
CONECT   14   19   19    1   35                                       
CONECT   15   17   17   16   16                                       
CONECT   15   18   12                                                 
CONECT   16   15   15                                                 
CONECT   17   15   15                                                 
CONECT   18   19   15    4    4                                       
CONECT   19   14   14   18   36                                       
CONECT   20   22   22   21   21                                       
CONECT   20    9   13                                                 
CONECT   21   20   20                                                 
CONECT   22   20   20                                                 
CONECT   23    9    9    2   37                                       
CONECT   24    2                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    8                                                      
CONECT   29    8                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   19                                                      
CONECT   37   23                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
