COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.162  -0.501  -0.055  1.00  0.00           C  
HETATM    2  C   UNL     1       3.718   0.718  -0.054  1.00  0.00           C  
HETATM    3  C   UNL     1       5.148   0.983  -0.239  1.00  0.00           C  
HETATM    4  C   UNL     1       1.223   0.747   0.295  1.00  0.00           C  
HETATM    5  C   UNL     1       1.777  -0.531   0.133  1.00  0.00           C  
HETATM    6  C   UNL     1       0.884  -1.639   0.182  1.00  0.00           C  
HETATM    7  C   UNL     1       0.416  -4.048  -0.039  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.875  -0.188   0.523  1.00  0.00           C  
HETATM    9  O   UNL     1       5.607   2.251  -0.221  1.00  0.00           O  
HETATM   10  N   UNL     1      -0.407  -1.414   0.376  1.00  0.00           N  
HETATM   11  N   UNL     1      -0.096   0.868   0.483  1.00  0.00           N  
HETATM   12  N   UNL     1       1.356  -2.927   0.030  1.00  0.00           N  
HETATM   13  C   UNL     1       3.974  -1.755  -0.251  1.00  0.00           C  
HETATM   14  O   UNL     1       5.921   0.059  -0.408  1.00  0.00           O  
HETATM   15  S   UNL     1       2.498   1.955   0.198  1.00  0.00           S  
HETATM   16  C   UNL     1      -2.354   0.005   0.738  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.050   0.161  -0.616  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.529   0.355  -0.401  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.369  -0.742  -0.350  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.725  -0.564  -0.148  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.240   0.709   0.003  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.400   1.806  -0.047  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.044   1.628  -0.250  1.00  0.00           C  
HETATM   24  H   UNL     1      -0.252  -3.910  -0.890  1.00  0.00           H  
HETATM   25  H   UNL     1       0.970  -4.979  -0.159  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.169  -4.089   0.879  1.00  0.00           H  
HETATM   27  H   UNL     1       6.558   2.376  -0.347  1.00  0.00           H  
HETATM   28  H   UNL     1       2.311  -3.089  -0.031  1.00  0.00           H  
HETATM   29  H   UNL     1       4.202  -2.196   0.720  1.00  0.00           H  
HETATM   30  H   UNL     1       3.405  -2.467  -0.849  1.00  0.00           H  
HETATM   31  H   UNL     1       4.903  -1.510  -0.765  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.762  -0.861   1.258  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.520   0.901   1.337  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.642   1.027  -1.137  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.884  -0.734  -1.215  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.966  -1.737  -0.468  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.381  -1.421  -0.108  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.300   0.848   0.161  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.803   2.801   0.071  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.387   2.485  -0.286  1.00  0.00           H  
CONECT    1    5   13    2    2                                       
CONECT    2    1    1   15    3                                       
CONECT    3    2   14   14    9                                       
CONECT    4   11   11    5   15                                       
CONECT    5    6    6    4    1                                       
CONECT    6   10   12    5    5                                       
CONECT    7   12   24   25   26                                       
CONECT    8   16   10   10   11                                       
CONECT    9    3   27                                                 
CONECT   10    8    8    6                                            
CONECT   11    8    4    4                                            
CONECT   12    7    6   28                                            
CONECT   13    1   29   30   31                                       
CONECT   14    3    3                                                 
CONECT   15    4    2                                                 
CONECT   16   17    8   32   33                                       
CONECT   17   18   16   34   35                                       
CONECT   18   19   19   23   17                                       
CONECT   19   20   18   18   36                                       
CONECT   20   21   21   19   37                                       
CONECT   21   20   20   22   38                                       
CONECT   22   21   23   23   39                                       
CONECT   23   22   22   18   40                                       
CONECT   24    7                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27    9                                                      
CONECT   28   12                                                      
CONECT   29   13                                                      
CONECT   30   13                                                      
CONECT   31   13                                                      
CONECT   32   16                                                      
CONECT   33   16                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
