COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.543  -2.891  -0.280  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.140  -2.659  -1.686  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.331  -1.313  -1.915  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.112  -0.395  -0.886  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.315   1.049  -1.123  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.114   2.893  -2.411  1.00  0.00           C  
HETATM    7  C   UNL     1       3.599  -0.768  -0.219  1.00  0.00           C  
HETATM    8  C   UNL     1       4.516   1.342  -0.235  1.00  0.00           C  
HETATM    9  C   UNL     1       6.901   1.605  -0.800  1.00  0.00           C  
HETATM   10  C   UNL     1       2.295   1.057   0.293  1.00  0.00           C  
HETATM   11  C   UNL     1       0.037   0.775   0.946  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.700  -0.849   0.369  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.513  -2.198   0.584  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.738  -3.102  -0.439  1.00  0.00           C  
HETATM   15  O   UNL     1      -3.581   1.116   1.748  1.00  0.00           O  
HETATM   16  O   UNL     1      -1.929  -0.453   2.775  1.00  0.00           O  
HETATM   17  N   UNL     1       4.646   0.029  -0.398  1.00  0.00           N  
HETATM   18  C   UNL     1       2.904  -4.375  -0.374  1.00  0.00           C  
HETATM   19  O   UNL     1       3.731  -2.104  -0.386  1.00  0.00           O  
HETATM   20  N   UNL     1       5.604   2.171  -0.421  1.00  0.00           N  
HETATM   21  N   UNL     1       3.339   1.856   0.109  1.00  0.00           N  
HETATM   22  N   UNL     1       1.069   1.592   0.656  1.00  0.00           N  
HETATM   23  N   UNL     1      -1.182   1.292   1.198  1.00  0.00           N  
HETATM   24  N   UNL     1       2.425  -0.255   0.129  1.00  0.00           N  
HETATM   25  O   UNL     1       0.205  -0.429   0.980  1.00  0.00           O  
HETATM   26  O   UNL     1      -3.010   1.854  -0.266  1.00  0.00           O  
HETATM   27  O   UNL     1      -3.837   1.473  -2.290  1.00  0.00           O  
HETATM   28  S   UNL     1      -2.419   0.301   1.675  1.00  0.00           S  
HETATM   29  H   UNL     1       1.862  -2.632  -1.090  1.00  0.00           H  
HETATM   30  H   UNL     1       2.061  -2.694   0.677  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.310  -3.370  -2.482  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.649  -0.969  -2.888  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.759   3.209  -1.592  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.177   3.450  -2.372  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.612   3.086  -3.361  1.00  0.00           H  
HETATM   36  H   UNL     1       7.231   0.907  -0.031  1.00  0.00           H  
HETATM   37  H   UNL     1       6.804   1.079  -1.750  1.00  0.00           H  
HETATM   38  H   UNL     1       7.632   2.407  -0.901  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.198  -2.551   1.555  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.590  -4.158  -0.265  1.00  0.00           H  
HETATM   41  H   UNL     1       3.653  -4.615   0.381  1.00  0.00           H  
HETATM   42  H   UNL     1       2.012  -4.978  -0.205  1.00  0.00           H  
HETATM   43  H   UNL     1       3.305  -4.590  -1.364  1.00  0.00           H  
HETATM   44  H   UNL     1       5.510   3.129  -0.301  1.00  0.00           H  
HETATM   45  H   UNL     1       0.954   2.554   0.702  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.334   2.245   1.100  1.00  0.00           H  
CONECT    1   19   18   29   30                                       
CONECT    2   14    3    3   31                                       
CONECT    3    2    2    4   32                                       
CONECT    4   12   12    3    5                                       
CONECT    5    4   26   26   27                                       
CONECT    6   27   33   34   35                                       
CONECT    7   17   19   24   24                                       
CONECT    8   20   17   17   21                                       
CONECT    9   20   36   37   38                                       
CONECT   10   21   21   24   22                                       
CONECT   11   22   25   25   23                                       
CONECT   12   13   28    4    4                                       
CONECT   13   14   14   12   39                                       
CONECT   14   13   13    2   40                                       
CONECT   15   28   28                                                 
CONECT   16   28   28                                                 
CONECT   17    8    8    7                                            
CONECT   18    1   41   42   43                                       
CONECT   19    7    1                                                 
CONECT   20    9    8   44                                            
CONECT   21    8   10   10                                            
CONECT   22   10   11   45                                            
CONECT   23   11   28   46                                            
CONECT   24    7    7   10                                            
CONECT   25   11   11                                                 
CONECT   26    5    5                                                 
CONECT   27    5    6                                                 
CONECT   28   23   16   16   15                                       
CONECT   28   15   12                                                 
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
