COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.615  -4.178   0.222  1.00  0.00           O  
HETATM    2  C   UNL     1       1.003  -3.035   0.066  1.00  0.00           C  
HETATM    3  N   UNL     1       2.132  -2.519   0.588  1.00  0.00           N  
HETATM    4  C   UNL     1       2.228  -1.190   0.185  1.00  0.00           C  
HETATM    5  N   UNL     1       0.373  -2.094  -0.659  1.00  0.00           N  
HETATM    6  C   UNL     1       1.109  -0.923  -0.602  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.873  -2.281  -1.402  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.046  -1.780  -0.611  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.141  -2.600  -0.411  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.221  -2.152   0.321  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.218  -0.874   0.847  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.041  -0.496  -0.099  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.128  -0.039   0.640  1.00  0.00           C  
HETATM   14  O   UNL     1      -3.128   1.214   1.164  1.00  0.00           O  
HETATM   15  C   UNL     1      -2.841   2.288   0.265  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.089   3.392   1.012  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.222   4.069   0.096  1.00  0.00           O  
HETATM   18  C   UNL     1       0.093   3.510   0.038  1.00  0.00           C  
HETATM   19  C   UNL     1       0.367   3.009  -1.380  1.00  0.00           C  
HETATM   20  O   UNL     1       1.683   2.459  -1.444  1.00  0.00           O  
HETATM   21  C   UNL     1       1.858   1.236  -0.889  1.00  0.00           C  
HETATM   22  N   UNL     1       0.956   0.294  -1.114  1.00  0.00           N  
HETATM   23  N   UNL     1       2.931   1.021  -0.147  1.00  0.00           N  
HETATM   24  C   UNL     1       3.155  -0.169   0.406  1.00  0.00           C  
HETATM   25  N   UNL     1       4.281  -0.389   1.187  1.00  0.00           N  
HETATM   26  C   UNL     1       5.242   0.694   1.408  1.00  0.00           C  
HETATM   27  H   UNL     1       2.768  -2.992   1.148  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.815  -1.734  -2.343  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.009  -3.342  -1.613  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.151  -3.595  -0.830  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.193   0.151  -0.271  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.070  -2.800   0.482  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.064  -0.524   1.420  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.226   1.921  -0.556  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.774   2.689  -0.131  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.804   4.101   1.429  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.499   2.951   1.815  1.00  0.00           H  
HETATM   38  H   UNL     1       0.825   4.272   0.303  1.00  0.00           H  
HETATM   39  H   UNL     1       0.165   2.677   0.738  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.361   2.242  -1.643  1.00  0.00           H  
HETATM   41  H   UNL     1       0.287   3.841  -2.081  1.00  0.00           H  
HETATM   42  H   UNL     1       4.431  -1.260   1.587  1.00  0.00           H  
HETATM   43  H   UNL     1       5.646   1.022   0.450  1.00  0.00           H  
HETATM   44  H   UNL     1       4.742   1.531   1.896  1.00  0.00           H  
HETATM   45  H   UNL     1       6.054   0.336   2.041  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    5                                       
CONECT    3    2    4   27                                            
CONECT    4    3    6   24   24                                       
CONECT    5    2    6    7                                            
CONECT    6    4    5   22   22                                       
CONECT    7    5    8   28   29                                       
CONECT    8    7    9   12   12                                       
CONECT    9    8   10   10   30                                       
CONECT   10    9    9   11   32                                       
CONECT   11   10   13   13   33                                       
CONECT   12    8    8   13   31                                       
CONECT   13   11   11   12   14                                       
CONECT   14   13   15                                                 
CONECT   15   14   16   34   35                                       
CONECT   16   15   17   36   37                                       
CONECT   17   16   18                                                 
CONECT   18   17   19   38   39                                       
CONECT   19   18   20   40   41                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   23   23                                       
CONECT   22    6    6   21                                            
CONECT   23   21   21   24                                            
CONECT   24    4    4   23   25                                       
CONECT   25   24   26   42                                            
CONECT   26   25   43   44   45                                       
CONECT   27    3                                                      
CONECT   28    7                                                      
CONECT   29    7                                                      
CONECT   30    9                                                      
CONECT   31   12                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   25                                                      
CONECT   43   26                                                      
CONECT   44   26                                                      
CONECT   45   26                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
