COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.070  -0.682   0.179  1.00  0.00           C  
HETATM    2  N   UNL     1      -1.043  -1.282   0.764  1.00  0.00           N  
HETATM    3  C   UNL     1       0.200  -0.963   0.426  1.00  0.00           C  
HETATM    4  N   UNL     1       1.291  -1.572   1.020  1.00  0.00           N  
HETATM    5  C   UNL     1       2.558  -1.273   0.702  1.00  0.00           C  
HETATM    6  O   UNL     1       3.453  -1.860   1.278  1.00  0.00           O  
HETATM    7  N   UNL     1       2.888  -0.354  -0.224  1.00  0.00           N  
HETATM    8  C   UNL     1       4.231  -0.087  -0.512  1.00  0.00           C  
HETATM    9  C   UNL     1       4.885  -0.801  -1.507  1.00  0.00           C  
HETATM   10  C   UNL     1       6.211  -0.535  -1.788  1.00  0.00           C  
HETATM   11  C   UNL     1       6.888   0.440  -1.080  1.00  0.00           C  
HETATM   12  C   UNL     1       6.241   1.154  -0.088  1.00  0.00           C  
HETATM   13  C   UNL     1       4.913   0.897   0.195  1.00  0.00           C  
HETATM   14 CL   UNL     1       4.098   1.798   1.435  1.00  0.00          Cl  
HETATM   15  C   UNL     1       1.814   0.367  -0.932  1.00  0.00           C  
HETATM   16  C   UNL     1       0.397   0.012  -0.554  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.906   0.242  -0.757  1.00  0.00           N  
HETATM   18  C   UNL     1      -0.689   0.613  -1.140  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.354  -1.036   0.552  1.00  0.00           N  
HETATM   20  C   UNL     1      -4.506  -0.388  -0.080  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.814   0.924   0.645  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.017   1.601  -0.015  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.232   0.674   0.068  1.00  0.00           C  
HETATM   24  O   UNL     1      -8.356   1.307  -0.549  1.00  0.00           O  
HETATM   25  C   UNL     1      -6.924  -0.637  -0.657  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.721  -1.314   0.003  1.00  0.00           C  
HETATM   27  H   UNL     1       1.132  -2.247   1.699  1.00  0.00           H  
HETATM   28  H   UNL     1       4.357  -1.564  -2.060  1.00  0.00           H  
HETATM   29  H   UNL     1       6.720  -1.091  -2.562  1.00  0.00           H  
HETATM   30  H   UNL     1       7.925   0.645  -1.303  1.00  0.00           H  
HETATM   31  H   UNL     1       6.773   1.915   0.463  1.00  0.00           H  
HETATM   32  H   UNL     1       1.952   1.434  -0.756  1.00  0.00           H  
HETATM   33  H   UNL     1       1.934   0.187  -2.000  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.558   1.369  -1.901  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.492  -1.714   1.233  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.278  -0.181  -1.125  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.043   0.716   1.691  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.949   1.583   0.586  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.237   2.535   0.501  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.789   1.808  -1.060  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.461   0.467   1.113  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.164   0.775  -0.533  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.790  -1.297  -0.599  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.696  -0.430  -1.703  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.502  -2.249  -0.513  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.950  -1.522   1.048  1.00  0.00           H  
CONECT    1   17   17   19    2                                       
CONECT    2    1    3    3                                            
CONECT    3    2    2   16    4                                       
CONECT    4    3    5   27                                            
CONECT    5    4    7    6    6                                       
CONECT    6    5    5                                                 
CONECT    7    5   15    8                                            
CONECT    8    7    9    9   13                                       
CONECT    9    8    8   10   28                                       
CONECT   10    9   11   11   29                                       
CONECT   11   10   10   12   30                                       
CONECT   12   11   13   13   31                                       
CONECT   13    8   12   12   14                                       
CONECT   14   13                                                      
CONECT   15    7   16   32   33                                       
CONECT   16    3   15   18   18                                       
CONECT   17    1    1   18                                            
CONECT   18   16   16   17   34                                       
CONECT   19    1   20   35                                            
CONECT   20   19   21   26   36                                       
CONECT   21   20   22   37   38                                       
CONECT   22   21   23   39   40                                       
CONECT   23   22   24   25   41                                       
CONECT   24   23   42                                                 
CONECT   25   23   26   43   44                                       
CONECT   26   20   25   45   46                                       
CONECT   27    4                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   15                                                      
CONECT   33   15                                                      
CONECT   34   18                                                      
CONECT   35   19                                                      
CONECT   36   20                                                      
CONECT   37   21                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
