COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.048   1.769   0.175  1.00  0.00           C  
HETATM    2  C   UNL     1       3.316   0.945   0.091  1.00  0.00           C  
HETATM    3  C   UNL     1       3.790  -1.532  -0.126  1.00  0.00           C  
HETATM    4  C   UNL     1       4.784   1.286   0.113  1.00  0.00           C  
HETATM    5  C   UNL     1       5.037   2.352   1.181  1.00  0.00           C  
HETATM    6  C   UNL     1       5.194   1.834  -1.255  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.775  -2.191   0.196  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.791  -1.052   0.115  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.074   0.262  -0.009  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.872   0.176   0.049  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.346  -1.140   0.155  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.421  -2.276   0.274  1.00  0.00           C  
HETATM   13  C   UNL     1       0.988  -1.988  -0.198  1.00  0.00           C  
HETATM   14  C   UNL     1       1.484  -0.601  -0.052  1.00  0.00           C  
HETATM   15  C   UNL     1       0.571   0.471   0.057  1.00  0.00           C  
HETATM   16  C   UNL     1       2.411   1.996   0.192  1.00  0.00           C  
HETATM   17  C   UNL     1       2.861  -0.351  -0.027  1.00  0.00           C  
HETATM   18  C   UNL     1       5.195  -1.078  -0.518  1.00  0.00           C  
HETATM   19  C   UNL     1       5.621   0.049   0.430  1.00  0.00           C  
HETATM   20  O   UNL     1      -1.931   0.973  -0.048  1.00  0.00           O  
HETATM   21  O   UNL     1      -0.760  -3.356   0.715  1.00  0.00           O  
HETATM   22  O   UNL     1       1.683  -2.860  -0.676  1.00  0.00           O  
HETATM   23  O   UNL     1      -5.249   0.488  -1.334  1.00  0.00           O  
HETATM   24  O   UNL     1      -5.306   0.711   1.155  1.00  0.00           O  
HETATM   25  O   UNL     1      -4.543   2.453  -0.239  1.00  0.00           O  
HETATM   26  S   UNL     1      -4.696   0.944  -0.107  1.00  0.00           S  
HETATM   27  H   UNL     1       0.358   2.597   0.249  1.00  0.00           H  
HETATM   28  H   UNL     1       3.832  -2.038   0.838  1.00  0.00           H  
HETATM   29  H   UNL     1       3.413  -2.224  -0.879  1.00  0.00           H  
HETATM   30  H   UNL     1       4.736   1.969   2.156  1.00  0.00           H  
HETATM   31  H   UNL     1       6.098   2.602   1.200  1.00  0.00           H  
HETATM   32  H   UNL     1       4.458   3.246   0.946  1.00  0.00           H  
HETATM   33  H   UNL     1       4.614   2.730  -1.476  1.00  0.00           H  
HETATM   34  H   UNL     1       6.256   2.082  -1.243  1.00  0.00           H  
HETATM   35  H   UNL     1       5.006   1.081  -2.020  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.035  -2.372   1.239  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.675  -1.934  -0.363  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.327  -3.089  -0.228  1.00  0.00           H  
HETATM   39  H   UNL     1       2.780   3.007   0.284  1.00  0.00           H  
HETATM   40  H   UNL     1       5.889  -1.914  -0.430  1.00  0.00           H  
HETATM   41  H   UNL     1       5.190  -0.713  -1.545  1.00  0.00           H  
HETATM   42  H   UNL     1       6.677   0.273   0.283  1.00  0.00           H  
HETATM   43  H   UNL     1       5.449  -0.256   1.462  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.382   2.929  -0.301  1.00  0.00           H  
CONECT    1   15   15   16   27                                       
CONECT    2   16   16   17    4                                       
CONECT    3   17   18   28   29                                       
CONECT    4    6    2    5   19                                       
CONECT    5    4   30   31   32                                       
CONECT    6    4   33   34   35                                       
CONECT    7    8   36   37   38                                       
CONECT    8    9    9    7   11                                       
CONECT    9   26   20    8    8                                       
CONECT   10   20   11   11   15                                       
CONECT   11    8   10   10   12                                       
CONECT   12   11   21   21   13                                       
CONECT   13   12   14   22   22                                       
CONECT   14   15   13   17   17                                       
CONECT   15   10    1    1   14                                       
CONECT   16    1    2    2   39                                       
CONECT   17   14   14    2    3                                       
CONECT   18    3   19   40   41                                       
CONECT   19    4   18   42   43                                       
CONECT   20    9   10                                                 
CONECT   21   12   12                                                 
CONECT   22   13   13                                                 
CONECT   23   26   26                                                 
CONECT   24   26   26                                                 
CONECT   25   26   44                                                 
CONECT   26   24   24   23   23                                       
CONECT   26   25    9                                                 
CONECT   27    1                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39   16                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   25                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
