COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.196  -4.015  -0.202  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.573  -4.138  -0.357  1.00  0.00           C  
HETATM    3  N   UNL     1      -2.366  -3.092  -0.346  1.00  0.00           N  
HETATM    4  C   UNL     1      -1.880  -1.860  -0.184  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.484  -1.663  -0.020  1.00  0.00           C  
HETATM    6  C   UNL     1       0.366  -2.779  -0.032  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.713  -0.728  -0.169  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.143   0.517   0.003  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.832   0.672   0.153  1.00  0.00           N  
HETATM   10  C   UNL     1       0.007  -0.349   0.149  1.00  0.00           C  
HETATM   11  C   UNL     1       1.459  -0.116   0.322  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.966   1.643   0.019  1.00  0.00           N  
HETATM   13  C   UNL     1       2.126   0.791  -0.502  1.00  0.00           C  
HETATM   14  C   UNL     1       3.479   1.004  -0.336  1.00  0.00           C  
HETATM   15  C   UNL     1       4.174   0.319   0.645  1.00  0.00           C  
HETATM   16  C   UNL     1       3.519  -0.582   1.465  1.00  0.00           C  
HETATM   17  C   UNL     1       2.164  -0.799   1.313  1.00  0.00           C  
HETATM   18  C   UNL     1       4.201   1.983  -1.225  1.00  0.00           C  
HETATM   19  C   UNL     1       1.370   1.537  -1.571  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.443   2.855   0.290  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.347   4.054   0.421  1.00  0.00           C  
HETATM   22  O   UNL     1      -1.245   2.982   0.431  1.00  0.00           O  
HETATM   23  H   UNL     1       0.430  -4.895  -0.211  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.001  -5.121  -0.490  1.00  0.00           H  
HETATM   25  H   UNL     1       1.433  -2.665   0.090  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.782  -0.831  -0.290  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.914   1.554  -0.166  1.00  0.00           H  
HETATM   28  H   UNL     1       5.233   0.488   0.771  1.00  0.00           H  
HETATM   29  H   UNL     1       4.067  -1.114   2.228  1.00  0.00           H  
HETATM   30  H   UNL     1       1.654  -1.503   1.954  1.00  0.00           H  
HETATM   31  H   UNL     1       4.174   2.974  -0.771  1.00  0.00           H  
HETATM   32  H   UNL     1       5.236   1.667  -1.347  1.00  0.00           H  
HETATM   33  H   UNL     1       3.713   2.017  -2.199  1.00  0.00           H  
HETATM   34  H   UNL     1       0.928   2.437  -1.143  1.00  0.00           H  
HETATM   35  H   UNL     1       2.054   1.814  -2.373  1.00  0.00           H  
HETATM   36  H   UNL     1       0.581   0.899  -1.970  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.381   3.747   0.264  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.242   4.482   1.418  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.072   4.799  -0.325  1.00  0.00           H  
CONECT    1    2    2    6   23                                       
CONECT    2    1    1    3   24                                       
CONECT    3    2    4    4                                            
CONECT    4    3    3    5    7                                       
CONECT    5    6    6    4   10                                       
CONECT    6    1    5    5   25                                       
CONECT    7    4    8    8   26                                       
CONECT    8    7    7    9   12                                       
CONECT    9   10   10    8                                            
CONECT   10    5   11    9    9                                       
CONECT   11   17   17   13   10                                       
CONECT   12    8   20   27                                            
CONECT   13   14   14   11   19                                       
CONECT   14   15   18   13   13                                       
CONECT   15   16   16   14   28                                       
CONECT   16   15   15   17   29                                       
CONECT   17   16   11   11   30                                       
CONECT   18   14   31   32   33                                       
CONECT   19   13   34   35   36                                       
CONECT   20   12   22   22   21                                       
CONECT   21   20   37   38   39                                       
CONECT   22   20   20                                                 
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27   12                                                      
CONECT   28   15                                                      
CONECT   29   16                                                      
CONECT   30   17                                                      
CONECT   31   18                                                      
CONECT   32   18                                                      
CONECT   33   18                                                      
CONECT   34   19                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
CONECT   37   21                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
