COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.168   1.549   0.067  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.310   2.318   0.102  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.571   1.718   0.092  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.701   0.360   0.047  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.551  -0.455   0.011  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.274   0.152   0.015  1.00  0.00           C  
HETATM    7  C   UNL     1       0.878  -0.670  -0.022  1.00  0.00           C  
HETATM    8  C   UNL     1       0.703  -2.028  -0.060  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.590  -2.562  -0.062  1.00  0.00           C  
HETATM   10  N   UNL     1      -1.657  -1.789  -0.039  1.00  0.00           N  
HETATM   11  O   UNL     1      -3.937  -0.206   0.039  1.00  0.00           O  
HETATM   12  N   UNL     1      -0.753  -3.941  -0.101  1.00  0.00           N  
HETATM   13  O   UNL     1      -1.209   3.672   0.147  1.00  0.00           O  
HETATM   14  N   UNL     1       2.158  -0.111  -0.019  1.00  0.00           N  
HETATM   15  C   UNL     1       3.200  -0.463   0.800  1.00  0.00           C  
HETATM   16  C   UNL     1       4.242   0.322   0.466  1.00  0.00           C  
HETATM   17  N   UNL     1       3.853   1.133  -0.530  1.00  0.00           N  
HETATM   18  C   UNL     1       2.609   0.880  -0.833  1.00  0.00           C  
HETATM   19  H   UNL     1       0.804   2.020   0.075  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.456   2.337   0.120  1.00  0.00           H  
HETATM   21  H   UNL     1       1.560  -2.684  -0.089  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.302  -0.340  -0.846  1.00  0.00           H  
HETATM   23  H   UNL     1       0.024  -4.521  -0.127  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.644  -4.324  -0.103  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.187   4.094  -0.723  1.00  0.00           H  
HETATM   26  H   UNL     1       3.188  -1.223   1.567  1.00  0.00           H  
HETATM   27  H   UNL     1       5.221   0.303   0.921  1.00  0.00           H  
HETATM   28  H   UNL     1       2.034   1.376  -1.601  1.00  0.00           H  
CONECT    1    6    2    2   19                                       
CONECT    2    1    1    3   13                                       
CONECT    3    4    4    2   20                                       
CONECT    4    5   11    3    3                                       
CONECT    5   10   10    6    4                                       
CONECT    6    7    7    5    1                                       
CONECT    7    8   14    6    6                                       
CONECT    8    9    9    7   21                                       
CONECT    9   12    8    8   10                                       
CONECT   10    9    5    5                                            
CONECT   11    4   22                                                 
CONECT   12    9   23   24                                            
CONECT   13    2   25                                                 
CONECT   14   15    7   18                                            
CONECT   15   16   16   14   26                                       
CONECT   16   15   15   17   27                                       
CONECT   17   16   18   18                                            
CONECT   18   14   17   17   28                                       
CONECT   19    1                                                      
CONECT   20    3                                                      
CONECT   21    8                                                      
CONECT   22   11                                                      
CONECT   23   12                                                      
CONECT   24   12                                                      
CONECT   25   13                                                      
CONECT   26   15                                                      
CONECT   27   16                                                      
CONECT   28   18                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
