COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.778  -2.861  -0.098  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.625  -4.166  -0.004  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.370  -4.742   0.087  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.250  -3.928   0.077  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.439  -2.553  -0.023  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.742  -2.034  -0.111  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.657  -0.689  -0.199  1.00  0.00           O  
HETATM    8  C   UNL     1      -1.375  -0.271  -0.175  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.539  -1.390  -0.066  1.00  0.00           C  
HETATM   10  N   UNL     1       0.779  -1.222  -0.024  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.775   0.994  -0.237  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.551   2.137  -0.345  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.710   3.342  -0.393  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.602   4.574  -0.572  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.558   4.623   0.490  1.00  0.00           O  
HETATM   16  C   UNL     1      -3.395   3.465   0.566  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.521   2.223   0.757  1.00  0.00           C  
HETATM   18  N   UNL     1       0.549   1.078  -0.189  1.00  0.00           N  
HETATM   19  C   UNL     1       1.304  -0.008  -0.085  1.00  0.00           C  
HETATM   20  C   UNL     1       2.779   0.142  -0.035  1.00  0.00           C  
HETATM   21  C   UNL     1       3.356   1.410  -0.098  1.00  0.00           C  
HETATM   22  C   UNL     1       4.728   1.547  -0.051  1.00  0.00           C  
HETATM   23  C   UNL     1       5.535   0.429   0.058  1.00  0.00           C  
HETATM   24  C   UNL     1       4.969  -0.836   0.120  1.00  0.00           C  
HETATM   25  O   UNL     1       5.766  -1.932   0.228  1.00  0.00           O  
HETATM   26  C   UNL     1       3.592  -0.983   0.080  1.00  0.00           C  
HETATM   27  H   UNL     1      -4.499  -4.800   0.004  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.265  -5.815   0.164  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.257  -4.348   0.147  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.149   3.432   0.537  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.017   3.269  -1.231  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.150   1.332   0.758  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.989   2.294   1.705  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.988   5.474  -0.551  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.123   4.510  -1.528  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.077   3.564   1.410  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.967   3.369  -0.357  1.00  0.00           H  
HETATM   38  H   UNL     1       2.728   2.285  -0.184  1.00  0.00           H  
HETATM   39  H   UNL     1       3.151  -1.967   0.134  1.00  0.00           H  
HETATM   40  H   UNL     1       5.173   2.530  -0.100  1.00  0.00           H  
HETATM   41  H   UNL     1       6.609   0.542   0.094  1.00  0.00           H  
HETATM   42  H   UNL     1       5.961  -2.190   1.139  1.00  0.00           H  
CONECT    1    2    6    6                                            
CONECT    2    1    3    3   27                                       
CONECT    3    2    2    4   28                                       
CONECT    4    3    5    5   29                                       
CONECT    5    4    4    6    9                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6    8                                                 
CONECT    8    7    9   11   11                                       
CONECT    9    5    8   10   10                                       
CONECT   10    9    9   19                                            
CONECT   11    8    8   12   18                                       
CONECT   12   11   13   17                                            
CONECT   13   12   14   30   31                                       
CONECT   14   13   15   34   35                                       
CONECT   15   14   16                                                 
CONECT   16   15   17   36   37                                       
CONECT   17   12   16   32   33                                       
CONECT   18   11   19   19                                            
CONECT   19   10   18   18   20                                       
CONECT   20   19   21   26   26                                       
CONECT   21   20   22   22   38                                       
CONECT   22   21   21   23   40                                       
CONECT   23   22   24   24   41                                       
CONECT   24   23   23   25   26                                       
CONECT   25   24   42                                                 
CONECT   26   20   20   24   39                                       
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30   13                                                      
CONECT   31   13                                                      
CONECT   32   17                                                      
CONECT   33   17                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   21                                                      
CONECT   39   26                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   25                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
