COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.285  -4.552  -2.070  1.00  0.00           C  
HETATM    2  O   UNL     1      -3.526  -4.139  -0.724  1.00  0.00           O  
HETATM    3  C   UNL     1      -2.674  -3.221  -0.199  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.782  -2.862   1.140  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.920  -1.931   1.676  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.693  -2.648  -0.999  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.826  -1.718  -0.470  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.935  -1.349   0.873  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.009  -0.351   1.444  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.038  -0.105   2.637  1.00  0.00           O  
HETATM   11  C   UNL     1       0.944   0.342   0.578  1.00  0.00           C  
HETATM   12  C   UNL     1       2.326  -0.101   0.392  1.00  0.00           C  
HETATM   13  C   UNL     1       2.982  -1.209   0.967  1.00  0.00           C  
HETATM   14  C   UNL     1       4.295  -1.472   0.672  1.00  0.00           C  
HETATM   15  C   UNL     1       4.996  -0.644  -0.200  1.00  0.00           C  
HETATM   16  O   UNL     1       6.298  -0.910  -0.490  1.00  0.00           O  
HETATM   17  C   UNL     1       4.371   0.444  -0.772  1.00  0.00           C  
HETATM   18  C   UNL     1       3.031   0.725  -0.481  1.00  0.00           C  
HETATM   19  S   UNL     1       2.003   2.028  -1.062  1.00  0.00           S  
HETATM   20  C   UNL     1       0.625   1.463  -0.139  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.699   2.110  -0.133  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.343   2.379   1.078  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.581   2.983   1.078  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.190   3.325  -0.123  1.00  0.00           C  
HETATM   25  O   UNL     1      -4.410   3.921  -0.118  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.554   3.059  -1.330  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.313   2.461  -1.339  1.00  0.00           C  
HETATM   28  H   UNL     1      -3.427  -3.704  -2.741  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.262  -4.918  -2.161  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.981  -5.347  -2.336  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.543  -3.312   1.760  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.610  -2.934  -2.038  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.004  -1.652   2.716  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.064  -1.274  -1.093  1.00  0.00           H  
HETATM   35  H   UNL     1       2.445  -1.856   1.645  1.00  0.00           H  
HETATM   36  H   UNL     1       4.787  -2.323   1.119  1.00  0.00           H  
HETATM   37  H   UNL     1       6.421  -1.489  -1.254  1.00  0.00           H  
HETATM   38  H   UNL     1       4.918   1.084  -1.448  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.871   2.113   2.012  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.817   2.259  -2.277  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.079   3.191   2.013  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.377   4.886  -0.164  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.031   3.326  -2.261  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    1    3                                                 
CONECT    3    2    4    6    6                                       
CONECT    4    3    5    5   31                                       
CONECT    5    4    4    8   33                                       
CONECT    6    3    3    7   32                                       
CONECT    7    6    8    8   34                                       
CONECT    8    5    7    7    9                                       
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12   20   20                                       
CONECT   12   11   13   18   18                                       
CONECT   13   12   14   14   35                                       
CONECT   14   13   13   15   36                                       
CONECT   15   14   16   17   17                                       
CONECT   16   15   37                                                 
CONECT   17   15   15   18   38                                       
CONECT   18   12   12   17   19                                       
CONECT   19   18   20                                                 
CONECT   20   11   11   19   21                                       
CONECT   21   20   22   27   27                                       
CONECT   22   21   23   23   39                                       
CONECT   23   22   22   24   41                                       
CONECT   24   23   25   26   26                                       
CONECT   25   24   42                                                 
CONECT   26   24   24   27   43                                       
CONECT   27   21   21   26   40                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   22                                                      
CONECT   40   27                                                      
CONECT   41   23                                                      
CONECT   42   25                                                      
CONECT   43   26                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
