COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.062   3.033   0.296  1.00  0.00           C  
HETATM    2  C   UNL     1       1.796   2.222   0.194  1.00  0.00           C  
HETATM    3  C   UNL     1       0.574   2.861   0.111  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.597   2.122   0.013  1.00  0.00           C  
HETATM    5  O   UNL     1      -1.786   2.771  -0.053  1.00  0.00           O  
HETATM    6  C   UNL     1      -2.944   2.106  -0.535  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.918   0.646  -0.166  1.00  0.00           C  
HETATM    8  N   UNL     1      -4.018   0.029   0.111  1.00  0.00           N  
HETATM    9  N   UNL     1      -4.020  -1.310   0.512  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.895  -2.051   0.454  1.00  0.00           C  
HETATM   11  O   UNL     1      -2.880  -3.173   0.915  1.00  0.00           O  
HETATM   12  C   UNL     1      -1.656  -1.479  -0.188  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.587  -1.921  -1.651  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.707  -0.019  -0.121  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.530   0.731  -0.005  1.00  0.00           C  
HETATM   16  C   UNL     1       0.695   0.089   0.084  1.00  0.00           C  
HETATM   17  C   UNL     1       1.862   0.835   0.177  1.00  0.00           C  
HETATM   18  N   UNL     1       3.102   0.191   0.260  1.00  0.00           N  
HETATM   19  C   UNL     1       3.170  -1.272   0.243  1.00  0.00           C  
HETATM   20  C   UNL     1       3.738  -1.851  -1.066  1.00  0.00           C  
HETATM   21  N   UNL     1       5.062  -1.773  -0.409  1.00  0.00           N  
HETATM   22  C   UNL     1       4.426  -1.843   0.925  1.00  0.00           C  
HETATM   23  H   UNL     1       3.292   3.217   1.345  1.00  0.00           H  
HETATM   24  H   UNL     1       3.883   2.484  -0.166  1.00  0.00           H  
HETATM   25  H   UNL     1       2.926   3.984  -0.219  1.00  0.00           H  
HETATM   26  H   UNL     1       0.530   3.940   0.123  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.830   2.569  -0.101  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.986   2.200  -1.620  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.841  -1.712   0.835  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.774  -1.837   0.342  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.693  -1.505  -2.115  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.550  -3.009  -1.701  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.470  -1.563  -2.181  1.00  0.00           H  
HETATM   34  H   UNL     1       0.742  -0.990   0.076  1.00  0.00           H  
HETATM   35  H   UNL     1       3.916   0.713   0.329  1.00  0.00           H  
HETATM   36  H   UNL     1       2.242  -1.744   0.566  1.00  0.00           H  
HETATM   37  H   UNL     1       3.411  -2.869  -1.274  1.00  0.00           H  
HETATM   38  H   UNL     1       3.633  -1.185  -1.922  1.00  0.00           H  
HETATM   39  H   UNL     1       5.607  -2.601  -0.594  1.00  0.00           H  
HETATM   40  H   UNL     1       4.870  -1.170   1.659  1.00  0.00           H  
HETATM   41  H   UNL     1       4.300  -2.859   1.299  1.00  0.00           H  
CONECT    1    2   23   24   25                                       
CONECT    2    1   17   17    3                                       
CONECT    3    2    4    4   26                                       
CONECT    4    3    3   15    5                                       
CONECT    5    4    6                                                 
CONECT    6    5    7   27   28                                       
CONECT    7   14    6    8    8                                       
CONECT    8    7    7    9                                            
CONECT    9   10    8   29                                            
CONECT   10   12   11   11    9                                       
CONECT   11   10   10                                                 
CONECT   12   13   14   10   30                                       
CONECT   13   12   31   32   33                                       
CONECT   14   15   12    7                                            
CONECT   15   16   16    4   14                                       
CONECT   16   17   15   15   34                                       
CONECT   17   18    2    2   16                                       
CONECT   18   19   17   35                                            
CONECT   19   20   18   22   36                                       
CONECT   20   19   21   37   38                                       
CONECT   21   20   22   39                                            
CONECT   22   19   21   40   41                                       
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    3                                                      
CONECT   27    6                                                      
CONECT   28    6                                                      
CONECT   29    9                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   16                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
