COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.618   0.000  -1.957  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.246  -0.005  -3.071  1.00  0.00           C  
HETATM    3  C   UNL     1       0.290  -0.002  -4.358  1.00  0.00           C  
HETATM    4  C   UNL     1       1.659  -0.007  -4.534  1.00  0.00           C  
HETATM    5  C   UNL     1       2.509  -0.008  -3.440  1.00  0.00           C  
HETATM    6  C   UNL     1       1.999  -0.004  -2.158  1.00  0.00           C  
HETATM    7  C   UNL     1       0.393   0.006   1.589  1.00  0.00           C  
HETATM    8  C   UNL     1       1.254   0.006   2.692  1.00  0.00           C  
HETATM    9  C   UNL     1       0.734   0.010   3.967  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.642   0.009   4.159  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.501   0.016   3.066  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.991   0.011   1.787  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.708   0.000  -2.876  1.00  0.00           C  
HETATM   14  C   UNL     1       1.660   0.009   5.157  1.00  0.00           C  
HETATM   15  N   UNL     1       0.108   0.003  -0.691  1.00  0.00           N  
HETATM   16  N   UNL     1       0.903   0.002   0.324  1.00  0.00           N  
HETATM   17  O   UNL     1      -2.171  -0.002  -1.753  1.00  0.00           O  
HETATM   18  O   UNL     1      -2.530   0.007  -3.944  1.00  0.00           O  
HETATM   19  O   UNL     1      -1.149   0.013   5.418  1.00  0.00           O  
HETATM   20  H   UNL     1      -0.364  -0.001  -5.216  1.00  0.00           H  
HETATM   21  H   UNL     1       2.071  -0.010  -5.533  1.00  0.00           H  
HETATM   22  H   UNL     1       3.578  -0.012  -3.592  1.00  0.00           H  
HETATM   23  H   UNL     1       2.669  -0.005  -1.311  1.00  0.00           H  
HETATM   24  H   UNL     1       2.324   0.002   2.544  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.570   0.020   3.221  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.659   0.012   0.939  1.00  0.00           H  
HETATM   27  H   UNL     1       1.886   1.037   5.441  1.00  0.00           H  
HETATM   28  H   UNL     1       1.179  -0.500   5.991  1.00  0.00           H  
HETATM   29  H   UNL     1       2.583  -0.507   4.898  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.488   0.011  -3.816  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.260  -0.911   5.678  1.00  0.00           H  
CONECT    1    2    6    6   15                                       
CONECT    2    1    3    3   13                                       
CONECT    3    2    2    4   20                                       
CONECT    4    3    5    5   21                                       
CONECT    5    4    4    6   22                                       
CONECT    6    1    1    5   23                                       
CONECT    7    8   12   12   16                                       
CONECT    8    7    9    9   24                                       
CONECT    9    8    8   10   14                                       
CONECT   10    9   11   11   19                                       
CONECT   11   10   10   12   25                                       
CONECT   12    7    7   11   26                                       
CONECT   13    2   17   17   18                                       
CONECT   14    9   27   28   29                                       
CONECT   15    1   16   16                                            
CONECT   16    7   15   15                                            
CONECT   17   13   13                                                 
CONECT   18   13   30                                                 
CONECT   19   10   31                                                 
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    8                                                      
CONECT   25   11                                                      
CONECT   26   12                                                      
CONECT   27   14                                                      
CONECT   28   14                                                      
CONECT   29   14                                                      
CONECT   30   18                                                      
CONECT   31   19                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
