COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.732  -2.027  -0.306  1.00  0.00           O  
HETATM    2  C   UNL     1       5.367  -0.873  -0.154  1.00  0.00           C  
HETATM    3  N   UNL     1       6.260   0.123  -0.066  1.00  0.00           N  
HETATM    4  C   UNL     1       3.933  -0.540  -0.068  1.00  0.00           C  
HETATM    5  C   UNL     1       3.576   0.813   0.107  1.00  0.00           C  
HETATM    6  N   UNL     1       4.589   1.756   0.190  1.00  0.00           N  
HETATM    7  C   UNL     1       5.890   1.375   0.097  1.00  0.00           C  
HETATM    8  N   UNL     1       6.858   2.336   0.184  1.00  0.00           N  
HETATM    9  C   UNL     1       2.243   1.173   0.192  1.00  0.00           C  
HETATM   10  C   UNL     1       1.262   0.199   0.104  1.00  0.00           C  
HETATM   11  C   UNL     1       1.612  -1.155  -0.071  1.00  0.00           C  
HETATM   12  C   UNL     1       2.952  -1.520  -0.157  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.121   0.234   0.151  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.566  -1.051   0.009  1.00  0.00           C  
HETATM   15  N   UNL     1       0.451  -1.864  -0.121  1.00  0.00           N  
HETATM   16  N   UNL     1      -1.891  -1.433   0.004  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.944  -0.426   0.160  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.312  -1.110   0.119  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.369  -0.100   0.275  1.00  0.00           N  
HETATM   20  C   UNL     1      -6.677  -0.735   0.479  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.725   0.339   0.781  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.791   1.324  -0.389  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.405   1.935  -0.611  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.395   0.815  -0.873  1.00  0.00           C  
HETATM   25  H   UNL     1       4.368   2.693   0.310  1.00  0.00           H  
HETATM   26  H   UNL     1       6.610   3.265   0.308  1.00  0.00           H  
HETATM   27  H   UNL     1       7.794   2.089   0.121  1.00  0.00           H  
HETATM   28  H   UNL     1       1.969   2.209   0.326  1.00  0.00           H  
HETATM   29  H   UNL     1       3.227  -2.556  -0.291  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.672   1.024   0.264  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.126  -2.368  -0.102  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.821   0.084   1.115  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.876   0.299  -0.651  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.436  -1.620  -0.836  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.380  -1.835   0.930  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.962  -1.277  -0.423  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.617  -1.430   1.316  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.699  -0.131   0.917  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.448   0.872   1.691  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.106   0.798  -1.291  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.505   2.115  -0.160  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.436   2.605  -1.470  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.107   2.493   0.276  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.404   1.245  -1.018  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.686   0.266  -1.769  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    4    1    1    3                                       
CONECT    3    2    7    7                                            
CONECT    4   12   12    5    2                                       
CONECT    5    9    9    4    6                                       
CONECT    6    5    7   25                                            
CONECT    7    6    3    3    8                                       
CONECT    8    7   26   27                                            
CONECT    9   10    5    5   28                                       
CONECT   10   13   11   11    9                                       
CONECT   11   15   10   10   12                                       
CONECT   12   11    4    4   29                                       
CONECT   13   14   10   30                                            
CONECT   14   16   13   15   15                                       
CONECT   15   14   14   11                                            
CONECT   16   17   14   31                                            
CONECT   17   18   16   32   33                                       
CONECT   18   19   17   34   35                                       
CONECT   19   20   24   18                                            
CONECT   20   21   19   36   37                                       
CONECT   21   22   20   38   39                                       
CONECT   22   21   23   40   41                                       
CONECT   23   22   24   42   43                                       
CONECT   24   23   19   44   45                                       
CONECT   25    6                                                      
CONECT   26    8                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29   12                                                      
CONECT   30   13                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
