COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.751   3.144  -0.235  1.00  0.00           C  
HETATM    2  C   UNL     1       2.847   1.645  -0.122  1.00  0.00           C  
HETATM    3  O   UNL     1       3.937   1.107  -0.081  1.00  0.00           O  
HETATM    4  C   UNL     1       1.678   0.869  -0.064  1.00  0.00           C  
HETATM    5  C   UNL     1       0.376   1.355  -0.101  1.00  0.00           C  
HETATM    6  N   UNL     1       1.626  -0.509   0.034  1.00  0.00           N  
HETATM    7  C   UNL     1       2.612  -1.449   0.103  1.00  0.00           C  
HETATM    8  C   UNL     1       2.271  -2.760   0.201  1.00  0.00           C  
HETATM    9  C   UNL     1       0.918  -3.116   0.228  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.011  -2.188   0.160  1.00  0.00           N  
HETATM   11  C   UNL     1       0.314  -0.896   0.064  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.483   0.263  -0.020  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.964   0.310  -0.022  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.689  -0.512  -0.883  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.068  -0.464  -0.880  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.731   0.398  -0.025  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.017   1.216   0.832  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.638   1.173   0.842  1.00  0.00           C  
HETATM   19  H   UNL     1       2.215   3.540   0.627  1.00  0.00           H  
HETATM   20  H   UNL     1       3.754   3.571  -0.267  1.00  0.00           H  
HETATM   21  H   UNL     1       2.216   3.406  -1.148  1.00  0.00           H  
HETATM   22  H   UNL     1       0.084   2.392  -0.179  1.00  0.00           H  
HETATM   23  H   UNL     1       3.650  -1.155   0.080  1.00  0.00           H  
HETATM   24  H   UNL     1       3.037  -3.520   0.256  1.00  0.00           H  
HETATM   25  H   UNL     1       0.636  -4.156   0.306  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.173  -1.186  -1.552  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.631  -1.101  -1.546  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.810   0.432  -0.026  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.540   1.888   1.497  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.081   1.809   1.514  1.00  0.00           H  
CONECT    1    2   19   20   21                                       
CONECT    2    3    3    4    1                                       
CONECT    3    2    2                                                 
CONECT    4    6    2    5    5                                       
CONECT    5    4    4   12   22                                       
CONECT    6    7   11    4                                            
CONECT    7    8    8    6   23                                       
CONECT    8    7    7    9   24                                       
CONECT    9    8   10   10   25                                       
CONECT   10    9    9   11                                            
CONECT   11    6   10   12   12                                       
CONECT   12   11   11    5   13                                       
CONECT   13   12   18   18   14                                       
CONECT   14   13   15   15   26                                       
CONECT   15   14   14   16   27                                       
CONECT   16   17   17   15   28                                       
CONECT   17   18   16   16   29                                       
CONECT   18   13   13   17   30                                       
CONECT   19    1                                                      
CONECT   20    1                                                      
CONECT   21    1                                                      
CONECT   22    5                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26   14                                                      
CONECT   27   15                                                      
CONECT   28   16                                                      
CONECT   29   17                                                      
CONECT   30   18                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
