COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.383   1.915   3.274  1.00  0.00           C  
HETATM    2  O   UNL     1       2.317   1.617   4.011  1.00  0.00           O  
HETATM    3  O   UNL     1       1.289   1.548   1.958  1.00  0.00           O  
HETATM    4  C   UNL     1       0.073   3.202   4.956  1.00  0.00           C  
HETATM    5  C   UNL     1       0.664   4.598   5.110  1.00  0.00           C  
HETATM    6  C   UNL     1       0.044   5.608   4.156  1.00  0.00           C  
HETATM    7  C   UNL     1       2.137   0.436  -0.031  1.00  0.00           C  
HETATM    8  N   UNL     1       1.961   1.638  -0.813  1.00  0.00           N  
HETATM    9  C   UNL     1       3.014   2.331  -1.384  1.00  0.00           C  
HETATM   10  O   UNL     1       4.201   2.037  -1.311  1.00  0.00           O  
HETATM   11  C   UNL     1       2.600   3.542  -2.151  1.00  0.00           C  
HETATM   12  C   UNL     1       0.949  -0.515  -0.197  1.00  0.00           C  
HETATM   13  O   UNL     1       0.906  -0.961  -1.554  1.00  0.00           O  
HETATM   14  C   UNL     1       1.107  -1.734   0.716  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.109  -2.477   0.674  1.00  0.00           O  
HETATM   16  C   UNL     1       2.368   0.767   1.447  1.00  0.00           C  
HETATM   17  O   UNL     1       2.557  -0.438   2.193  1.00  0.00           O  
HETATM   18  N   UNL     1       0.280   2.660   3.632  1.00  0.00           N  
HETATM   19  C   UNL     1       1.425  -1.314   2.156  1.00  0.00           C  
HETATM   20  C   UNL     1       1.759  -2.511   3.042  1.00  0.00           C  
HETATM   21  O   UNL     1       2.050  -2.040   4.344  1.00  0.00           O  
HETATM   22  H   UNL     1      -0.428   2.839   2.926  1.00  0.00           H  
HETATM   23  H   UNL     1       3.277   1.368   1.559  1.00  0.00           H  
HETATM   24  H   UNL     1       0.550   2.513   5.661  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.003   3.202   5.154  1.00  0.00           H  
HETATM   26  H   UNL     1       0.499   4.940   6.139  1.00  0.00           H  
HETATM   27  H   UNL     1       1.748   4.568   4.948  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.040   5.670   4.300  1.00  0.00           H  
HETATM   29  H   UNL     1       0.465   6.603   4.334  1.00  0.00           H  
HETATM   30  H   UNL     1       0.239   5.343   3.112  1.00  0.00           H  
HETATM   31  H   UNL     1       3.032  -0.052  -0.435  1.00  0.00           H  
HETATM   32  H   UNL     1       1.019   1.992  -0.952  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.003  -0.005  -0.003  1.00  0.00           H  
HETATM   34  H   UNL     1       3.057   4.465  -1.758  1.00  0.00           H  
HETATM   35  H   UNL     1       2.905   3.494  -3.209  1.00  0.00           H  
HETATM   36  H   UNL     1       1.517   3.741  -2.170  1.00  0.00           H  
HETATM   37  H   UNL     1       1.705  -1.490  -1.693  1.00  0.00           H  
HETATM   38  H   UNL     1       1.900  -2.383   0.324  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.383  -2.504  -0.255  1.00  0.00           H  
HETATM   40  H   UNL     1       0.560  -0.813   2.608  1.00  0.00           H  
HETATM   41  H   UNL     1       2.628  -3.035   2.645  1.00  0.00           H  
HETATM   42  H   UNL     1       0.907  -3.190   3.085  1.00  0.00           H  
HETATM   43  H   UNL     1       2.976  -2.268   4.531  1.00  0.00           H  
CONECT    1    2    2    3   18                                       
CONECT    2    1    1                                                 
CONECT    3    1   16                                                 
CONECT    4    5   18   24   25                                       
CONECT    5    4    6   26   27                                       
CONECT    6    5   28   29   30                                       
CONECT    7    8   12   16   31                                       
CONECT    8    7    9   32                                            
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   34   35   36                                       
CONECT   12    7   13   14   33                                       
CONECT   13   12   37                                                 
CONECT   14   12   15   19   38                                       
CONECT   15   14   39                                                 
CONECT   16    3    7   17   23                                       
CONECT   17   16   19                                                 
CONECT   18    1    4   22                                            
CONECT   19   14   17   20   40                                       
CONECT   20   19   21   41   42                                       
CONECT   21   20   43                                                 
CONECT   22   18                                                      
CONECT   23   16                                                      
CONECT   24    4                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   12                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
