COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.629  -0.509  -0.264  1.00  0.00           N  
HETATM    2  C   UNL     1       5.609  -0.398  -1.355  1.00  0.00           C  
HETATM    3  C   UNL     1       6.729  -1.373  -0.945  1.00  0.00           C  
HETATM    4  N   UNL     1       6.262  -1.931   0.333  1.00  0.00           N  
HETATM    5  C   UNL     1       5.075  -1.390   0.640  1.00  0.00           C  
HETATM    6  N   UNL     1      -5.703   0.236  -0.144  1.00  0.00           N  
HETATM    7  N   UNL     1      -5.027   1.321  -0.026  1.00  0.00           N  
HETATM    8  C   UNL     1      -3.681   1.021  -0.064  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.617  -0.454  -0.228  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.902  -0.854  -0.268  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.374  -2.276  -0.423  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.235  -2.862   0.697  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.870  -2.504  -0.648  1.00  0.00           C  
HETATM   14  N   UNL     1      -2.676   1.858   0.026  1.00  0.00           N  
HETATM   15  C   UNL     1      -1.410   1.398  -0.030  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.254   2.360   0.073  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.202   0.215  -0.162  1.00  0.00           O  
HETATM   18  C   UNL     1       1.043   1.598  -0.016  1.00  0.00           C  
HETATM   19  C   UNL     1       1.938   1.876  -1.033  1.00  0.00           C  
HETATM   20  C   UNL     1       3.128   1.180  -1.118  1.00  0.00           C  
HETATM   21  C   UNL     1       3.425   0.199  -0.181  1.00  0.00           C  
HETATM   22  C   UNL     1       2.524  -0.079   0.839  1.00  0.00           C  
HETATM   23  C   UNL     1       1.338   0.625   0.921  1.00  0.00           C  
HETATM   24  O   UNL     1       4.459  -1.675   1.649  1.00  0.00           O  
HETATM   25  C   UNL     1      -0.321   3.096   1.413  1.00  0.00           C  
HETATM   26  H   UNL     1       5.163  -0.702  -2.302  1.00  0.00           H  
HETATM   27  H   UNL     1       5.993   0.620  -1.422  1.00  0.00           H  
HETATM   28  H   UNL     1       6.840  -2.163  -1.689  1.00  0.00           H  
HETATM   29  H   UNL     1       7.670  -0.840  -0.809  1.00  0.00           H  
HETATM   30  H   UNL     1       6.737  -2.585   0.868  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.733  -1.071  -0.299  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.681  -2.949  -0.929  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.109  -3.919   0.929  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.461  -2.217   1.548  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.513  -1.624  -0.683  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.162  -3.326  -1.301  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.308   3.082  -0.742  1.00  0.00           H  
HETATM   38  H   UNL     1       1.707   2.639  -1.761  1.00  0.00           H  
HETATM   39  H   UNL     1       3.826   1.398  -1.912  1.00  0.00           H  
HETATM   40  H   UNL     1       2.751  -0.841   1.569  1.00  0.00           H  
HETATM   41  H   UNL     1       0.639   0.413   1.717  1.00  0.00           H  
HETATM   42  H   UNL     1       0.515   3.792   1.487  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.259   3.648   1.477  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.267   2.374   2.227  1.00  0.00           H  
CONECT    1    2    5   21                                            
CONECT    2    1    3   26   27                                       
CONECT    3    2    4   28   29                                       
CONECT    4    3    5   30                                            
CONECT    5    1    4   24   24                                       
CONECT    6    7    7   10                                            
CONECT    7    6    6    8                                            
CONECT    8    7    9   14   14                                       
CONECT    9    8   10   10   31                                       
CONECT   10    6    9    9   11                                       
CONECT   11   10   12   13   32                                       
CONECT   12   11   13   33   34                                       
CONECT   13   11   12   35   36                                       
CONECT   14    8    8   15                                            
CONECT   15   14   16   17   17                                       
CONECT   16   15   18   25   37                                       
CONECT   17   15   15                                                 
CONECT   18   16   19   19   23                                       
CONECT   19   18   18   20   38                                       
CONECT   20   19   21   21   39                                       
CONECT   21    1   20   20   22                                       
CONECT   22   21   23   23   40                                       
CONECT   23   18   22   22   41                                       
CONECT   24    5    5                                                 
CONECT   25   16   42   43   44                                       
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    9                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   16                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   25                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
