COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.924   1.624  -1.508  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.894  -1.042  -1.117  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.614  -2.297  -1.617  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.376  -3.385  -1.231  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.424  -3.222  -0.342  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.714  -1.973   0.166  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.153   0.645   0.396  1.00  0.00           C  
HETATM    8  C   UNL     1       1.147   0.662  -0.058  1.00  0.00           C  
HETATM    9  C   UNL     1       1.538   1.601  -1.021  1.00  0.00           C  
HETATM   10  C   UNL     1       0.604   2.518  -1.518  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.693   2.493  -1.059  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.078   1.555  -0.105  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.075   2.576   0.935  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.312   2.126   1.229  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.255   0.471   0.319  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.949  -0.871  -0.220  1.00  0.00           C  
HETATM   17  I   UNL     1       2.538  -0.714   0.693  1.00  0.00           I  
HETATM   18  N   UNL     1      -2.396   1.534   0.357  1.00  0.00           N  
HETATM   19  N   UNL     1      -4.397   0.845   0.852  1.00  0.00           N  
HETATM   20  H   UNL     1       3.223   2.349  -2.250  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.295  -0.194  -1.416  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.798  -2.431  -2.312  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.153  -4.365  -1.625  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.016  -4.076  -0.044  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.533  -1.847   0.859  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.456  -0.078   1.138  1.00  0.00           H  
HETATM   27  H   UNL     1       0.901   3.244  -2.260  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.414   3.200  -1.441  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.694   3.570   1.116  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.100   2.702   1.692  1.00  0.00           H  
HETATM   31  O   UNL     1       3.733   0.832  -1.072  1.00  0.00           O  
CONECT    1    9   20   31   31                                       
CONECT    2   16   16    3   21                                       
CONECT    3    2    4    4   22                                       
CONECT    4    3    3    5   23                                       
CONECT    5    6    6    4   24                                       
CONECT    6   16    5    5   25                                       
CONECT    7    8    8   12   26                                       
CONECT    8    9   17    7    7                                       
CONECT    9    1   10   10    8                                       
CONECT   10    9    9   11   27                                       
CONECT   11   10   12   12   28                                       
CONECT   12   11   11    7   18                                       
CONECT   13   18   14   14   29                                       
CONECT   14   13   13   19   30                                       
CONECT   15   18   16   19   19                                       
CONECT   16   15    2    2    6                                       
CONECT   17    8                                                      
CONECT   18   12   13   15                                            
CONECT   19   15   15   14                                            
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    4                                                      
CONECT   24    5                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27   10                                                      
CONECT   28   11                                                      
CONECT   29   13                                                      
CONECT   30   14                                                      
CONECT   31    1    1                                                 
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
