COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.847  -0.046  -0.397  1.00  0.00           N  
HETATM    2  C   UNL     1       0.180  -0.843  -0.753  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.997  -0.600   0.168  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.917  -1.699   0.997  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.208  -1.772   1.335  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.402  -0.652   0.511  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.808   0.971  -0.538  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.270  -0.045  -0.091  1.00  0.00           C  
HETATM    9  C   UNL     1       1.420   2.035  -0.508  1.00  0.00           C  
HETATM   10  C   UNL     1       3.052   2.766   1.079  1.00  0.00           C  
HETATM   11  C   UNL     1       3.837  -0.805   0.190  1.00  0.00           C  
HETATM   12 CL   UNL     1       1.178   4.586   0.363  1.00  0.00          Cl  
HETATM   13  C   UNL     1       1.934   3.024   0.307  1.00  0.00           C  
HETATM   14  C   UNL     1       3.649   1.524   1.025  1.00  0.00           C  
HETATM   15  C   UNL     1       3.129   0.527   0.211  1.00  0.00           C  
HETATM   16  N   UNL     1       3.004  -1.795  -0.504  1.00  0.00           N  
HETATM   17  C   UNL     1       2.834  -3.037  -0.009  1.00  0.00           C  
HETATM   18  O   UNL     1       2.141  -3.836  -0.602  1.00  0.00           O  
HETATM   19  C   UNL     1       3.505  -3.433   1.281  1.00  0.00           C  
HETATM   20  C   UNL     1       2.013   0.780  -0.556  1.00  0.00           C  
HETATM   21  C   UNL     1       1.383  -0.257  -1.448  1.00  0.00           C  
HETATM   22  C   UNL     1       2.373  -1.376  -1.766  1.00  0.00           C  
HETATM   23  O   UNL     1       0.137  -2.031  -0.515  1.00  0.00           O  
HETATM   24  C   UNL     1      -3.441   1.075  -0.916  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.694   1.566  -1.128  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.678  -0.121   0.265  1.00  0.00           C  
HETATM   27  N   UNL     1      -2.998  -2.238   1.542  1.00  0.00           N  
HETATM   28  H   UNL     1      -0.785   0.913  -0.529  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.950  -2.132   1.207  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.056  -2.249   1.804  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.790   1.380  -0.723  1.00  0.00           H  
HETATM   32  H   UNL     1       0.547   2.238  -1.111  1.00  0.00           H  
HETATM   33  H   UNL     1       3.456   3.534   1.722  1.00  0.00           H  
HETATM   34  H   UNL     1       4.786  -0.702  -0.336  1.00  0.00           H  
HETATM   35  H   UNL     1       4.023  -1.133   1.212  1.00  0.00           H  
HETATM   36  H   UNL     1       4.524   1.322   1.626  1.00  0.00           H  
HETATM   37  H   UNL     1       2.845  -3.206   2.118  1.00  0.00           H  
HETATM   38  H   UNL     1       3.719  -4.502   1.266  1.00  0.00           H  
HETATM   39  H   UNL     1       4.436  -2.878   1.391  1.00  0.00           H  
HETATM   40  H   UNL     1       1.065   0.215  -2.377  1.00  0.00           H  
HETATM   41  H   UNL     1       3.134  -1.009  -2.455  1.00  0.00           H  
HETATM   42  H   UNL     1       1.846  -2.219  -2.213  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.587   1.545  -1.380  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.827   2.429  -1.764  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.550  -0.572   0.716  1.00  0.00           H  
CONECT    1    3    2   28                                            
CONECT    2    1   21   23   23                                       
CONECT    3    8    8    4    1                                       
CONECT    4   27   27    3   29                                       
CONECT    5    6    6   27   30                                       
CONECT    6   26    5    5    8                                       
CONECT    7   26   26   25   31                                       
CONECT    8    6   24    3    3                                       
CONECT    9   20   20   13   32                                       
CONECT   10   13   13   14   33                                       
CONECT   11   16   15   34   35                                       
CONECT   12   13                                                      
CONECT   13    9   12   10   10                                       
CONECT   14   15   15   10   36                                       
CONECT   15   20   11   14   14                                       
CONECT   16   22   17   11                                            
CONECT   17   18   18   16   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   37   38   39                                       
CONECT   20   21    9    9   15                                       
CONECT   21    2   22   20   40                                       
CONECT   22   21   16   41   42                                       
CONECT   23    2    2                                                 
CONECT   24   25   25    8   43                                       
CONECT   25    7   24   24   44                                       
CONECT   26    7    7    6   45                                       
CONECT   27    5    4    4                                            
CONECT   28    1                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   14                                                      
CONECT   37   19                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   22                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
