COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.099   0.003  -3.489  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.191  -1.652   0.969  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.827  -1.043  -0.270  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.008   0.991   4.421  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.084   0.831   5.436  1.00  0.00           C  
HETATM    6  C   UNL     1       0.107   0.163   5.194  1.00  0.00           C  
HETATM    7  C   UNL     1       0.374  -0.339   3.930  1.00  0.00           C  
HETATM    8  C   UNL     1       0.461   0.629   7.355  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.706   1.782  -5.504  1.00  0.00           N  
HETATM   10  S   UNL     1      -0.177   0.236  -5.234  1.00  0.00           S  
HETATM   11  O   UNL     1       1.169   0.204  -5.688  1.00  0.00           O  
HETATM   12  O   UNL     1      -1.219  -0.614  -5.690  1.00  0.00           O  
HETATM   13  S   UNL     1       1.264   0.305  -2.372  1.00  0.00           S  
HETATM   14  C   UNL     1       0.457  -0.196  -0.886  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.796  -0.559  -1.277  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.055  -0.449  -2.646  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.293  -0.692   1.640  1.00  0.00           N  
HETATM   18  S   UNL     1       1.063  -0.254   0.755  1.00  0.00           S  
HETATM   19  O   UNL     1       1.366   1.085   1.120  1.00  0.00           O  
HETATM   20  O   UNL     1       1.953  -1.360   0.817  1.00  0.00           O  
HETATM   21  C   UNL     1      -0.556  -0.182   2.913  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.748   0.487   3.161  1.00  0.00           C  
HETATM   23  O   UNL     1       1.014   0.007   6.194  1.00  0.00           O  
HETATM   24  H   UNL     1      -0.619  -2.533   0.679  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.977  -1.950   1.663  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.460  -1.792  -0.745  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.449  -0.199   0.030  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.935   1.511   4.613  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.290   1.227   6.420  1.00  0.00           H  
HETATM   30  H   UNL     1       1.302  -0.859   3.740  1.00  0.00           H  
HETATM   31  H   UNL     1       1.157   0.528   8.188  1.00  0.00           H  
HETATM   32  H   UNL     1       0.286   1.686   7.153  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.482   0.147   7.610  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.816   2.105  -6.412  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.906   2.364  -4.754  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.024  -0.728  -3.033  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.471   0.614   2.370  1.00  0.00           H  
CONECT    1   10   13   16   16                                       
CONECT    2    3   17   24   25                                       
CONECT    3    2   15   26   27                                       
CONECT    4    5    5   22   28                                       
CONECT    5    4    4    6   29                                       
CONECT    6    5    7    7   23                                       
CONECT    7    6    6   21   30                                       
CONECT    8   23   31   32   33                                       
CONECT    9   10   34   35                                            
CONECT   10    1    9   11   11                                       
CONECT   10   12   12                                                 
CONECT   11   10   10                                                 
CONECT   12   10   10                                                 
CONECT   13    1   14                                                 
CONECT   14   13   15   15   18                                       
CONECT   15    3   14   14   16                                       
CONECT   16    1    1   15   36                                       
CONECT   17    2   18   21                                            
CONECT   18   14   17   19   19                                       
CONECT   18   20   20                                                 
CONECT   19   18   18                                                 
CONECT   20   18   18                                                 
CONECT   21    7   17   22   22                                       
CONECT   22    4   21   21   37                                       
CONECT   23    6    8                                                 
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   16                                                      
CONECT   37   22                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
