COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.510  -0.171   1.601  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.793  -1.329   0.990  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.589  -1.496   0.331  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.809  -0.393   0.023  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.246  -1.892  -0.960  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.896  -1.874  -1.679  1.00  0.00           C  
HETATM    7  C   UNL     1       2.485  -0.918  -0.222  1.00  0.00           C  
HETATM    8  C   UNL     1       4.002   0.791   0.754  1.00  0.00           C  
HETATM    9  C   UNL     1       3.967   3.048  -0.052  1.00  0.00           C  
HETATM   10  C   UNL     1       2.479   1.445  -1.018  1.00  0.00           C  
HETATM   11  O   UNL     1       4.534  -2.261   2.333  1.00  0.00           O  
HETATM   12  C   UNL     1       4.061  -1.438   1.569  1.00  0.00           C  
HETATM   13  C   UNL     1       3.014  -1.842   0.633  1.00  0.00           C  
HETATM   14  C   UNL     1       2.989   0.463  -0.164  1.00  0.00           C  
HETATM   15  C   UNL     1       1.393   1.099  -2.004  1.00  0.00           C  
HETATM   16  C   UNL     1       2.968   2.719  -0.957  1.00  0.00           C  
HETATM   17  C   UNL     1       4.485   2.097   0.800  1.00  0.00           C  
HETATM   18  C   UNL     1       1.418  -1.296  -1.180  1.00  0.00           C  
HETATM   19  O   UNL     1       1.695  -1.516  -2.342  1.00  0.00           O  
HETATM   20  N   UNL     1       0.141  -1.395  -0.762  1.00  0.00           N  
HETATM   21  O   UNL     1      -2.625  -0.555  -0.626  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.241   0.881   0.378  1.00  0.00           C  
HETATM   23  O   UNL     1      -3.479   1.967   0.077  1.00  0.00           O  
HETATM   24  C   UNL     1      -3.985   3.244   0.473  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.222  -0.063   1.343  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.449   1.041   1.038  1.00  0.00           C  
HETATM   27  H   UNL     1       5.209   0.070   2.229  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.402  -2.190   1.225  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.256  -2.486   0.056  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.000  -2.331  -1.613  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.164  -2.485  -0.049  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.649  -2.882  -2.013  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.952  -1.210  -2.542  1.00  0.00           H  
HETATM   34  H   UNL     1       4.343   4.060  -0.015  1.00  0.00           H  
HETATM   35  H   UNL     1       2.662  -2.862   0.618  1.00  0.00           H  
HETATM   36  H   UNL     1       1.836   0.624  -2.880  1.00  0.00           H  
HETATM   37  H   UNL     1       0.685   0.413  -1.539  1.00  0.00           H  
HETATM   38  H   UNL     1       0.874   2.008  -2.307  1.00  0.00           H  
HETATM   39  H   UNL     1       2.572   3.477  -1.617  1.00  0.00           H  
HETATM   40  H   UNL     1       5.262   2.362   1.501  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.092  -1.150   0.147  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.283   4.022   0.173  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.947   3.419  -0.009  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.112   3.266   1.555  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.163   0.063   1.857  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.786   2.029   1.315  1.00  0.00           H  
CONECT    1   12    8   27                                            
CONECT    2    3    3   25   28                                       
CONECT    3    2    2    4   29                                       
CONECT    4    3   21   22   22                                       
CONECT    5    6   21   30   31                                       
CONECT    6   20    5   32   33                                       
CONECT    7   13   13   14   18                                       
CONECT    8    1   17   17   14                                       
CONECT    9   17   16   16   34                                       
CONECT   10   14   14   16   15                                       
CONECT   11   12   12                                                 
CONECT   12   11   11    1   13                                       
CONECT   13   12    7    7   35                                       
CONECT   14    8    7   10   10                                       
CONECT   15   10   36   37   38                                       
CONECT   16    9    9   10   39                                       
CONECT   17    8    8    9   40                                       
CONECT   18    7   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18    6   41                                            
CONECT   21    5    4                                                 
CONECT   22    4    4   26   23                                       
CONECT   23   22   24                                                 
CONECT   24   23   42   43   44                                       
CONECT   25    2   26   26   45                                       
CONECT   26   25   25   22   46                                       
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    9                                                      
CONECT   35   13                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   20                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
