COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.657  -1.921   0.668  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.340  -3.186   1.115  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.244  -3.853   0.595  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.459  -3.258  -0.377  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.763  -1.993  -0.835  1.00  0.00           C  
HETATM    6  C   UNL     1       0.093  -1.347  -1.893  1.00  0.00           C  
HETATM    7  C   UNL     1       1.133  -0.477  -1.236  1.00  0.00           C  
HETATM    8  C   UNL     1       2.296  -1.036  -0.800  1.00  0.00           C  
HETATM    9  C   UNL     1       3.268  -0.228  -0.187  1.00  0.00           C  
HETATM   10  C   UNL     1       4.480  -0.769   0.275  1.00  0.00           C  
HETATM   11  C   UNL     1       5.399   0.044   0.864  1.00  0.00           C  
HETATM   12  C   UNL     1       5.157   1.408   1.017  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.558   1.002   0.083  1.00  0.00           C  
HETATM   14  O   UNL     1      -3.423   3.252   0.470  1.00  0.00           O  
HETATM   15  C   UNL     1      -3.066   2.291  -0.406  1.00  0.00           C  
HETATM   16  C   UNL     1       3.995   1.967   0.582  1.00  0.00           C  
HETATM   17  C   UNL     1       3.022   1.159  -0.031  1.00  0.00           C  
HETATM   18  C   UNL     1       1.810   1.699  -0.493  1.00  0.00           C  
HETATM   19  C   UNL     1       0.894   0.887  -1.088  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.201   0.037  -0.797  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.869  -1.312  -0.314  1.00  0.00           C  
HETATM   22  O   UNL     1      -3.165   2.491  -1.601  1.00  0.00           O  
HETATM   23  S   UNL     1      -2.415   0.712   1.815  1.00  0.00           S  
HETATM   24  H   UNL     1      -3.515  -1.404   1.072  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.947  -3.658   1.873  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.000  -4.844   0.950  1.00  0.00           H  
HETATM   27  H   UNL     1       0.395  -3.784  -0.777  1.00  0.00           H  
HETATM   28  H   UNL     1       0.585  -2.119  -2.484  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.533  -0.735  -2.543  1.00  0.00           H  
HETATM   30  H   UNL     1       2.469  -2.095  -0.925  1.00  0.00           H  
HETATM   31  H   UNL     1       4.682  -1.824   0.164  1.00  0.00           H  
HETATM   32  H   UNL     1       6.330  -0.374   1.219  1.00  0.00           H  
HETATM   33  H   UNL     1       5.903   2.031   1.488  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.751   4.083   0.101  1.00  0.00           H  
HETATM   35  H   UNL     1       3.821   3.025   0.708  1.00  0.00           H  
HETATM   36  H   UNL     1       1.609   2.754  -0.380  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.037   1.306  -1.442  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.159   0.258  -1.853  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.928  -0.540   1.873  1.00  0.00           H  
CONECT    1    2    2   21   24                                       
CONECT    2    1    1    3   25                                       
CONECT    3    2    4    4   26                                       
CONECT    4    3    3    5   27                                       
CONECT    5   21   21    4    6                                       
CONECT    6    5    7   28   29                                       
CONECT    7   19   19    8    6                                       
CONECT    8    9    9    7   30                                       
CONECT    9   17    8    8   10                                       
CONECT   10   11   11    9   31                                       
CONECT   11   12   10   10   32                                       
CONECT   12   16   16   11   33                                       
CONECT   13   20   20   15   23                                       
CONECT   14   15   34                                                 
CONECT   15   22   22   13   14                                       
CONECT   16   12   12   17   35                                       
CONECT   17   16   18   18    9                                       
CONECT   18   17   17   19   36                                       
CONECT   19   18    7    7   37                                       
CONECT   20   21   13   13   38                                       
CONECT   21    1   20    5    5                                       
CONECT   22   15   15                                                 
CONECT   23   13   39                                                 
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    8                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   14                                                      
CONECT   35   16                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   23                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
