COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.907   1.932  -1.279  1.00  0.00           C  
HETATM    2  C   UNL     1       3.815   1.183  -0.301  1.00  0.00           C  
HETATM    3  C   UNL     1       4.532   2.184   0.607  1.00  0.00           C  
HETATM    4  N   UNL     1       4.803   0.396  -1.048  1.00  0.00           N  
HETATM    5  C   UNL     1       5.225  -0.748  -0.580  1.00  0.00           C  
HETATM    6  N   UNL     1       6.189  -1.444  -1.282  1.00  0.00           N  
HETATM    7  N   UNL     1       4.750  -1.268   0.564  1.00  0.00           N  
HETATM    8  C   UNL     1       3.664  -0.779   1.133  1.00  0.00           C  
HETATM    9  N   UNL     1       3.200  -1.293   2.311  1.00  0.00           N  
HETATM   10  N   UNL     1       3.011   0.261   0.515  1.00  0.00           N  
HETATM   11  O   UNL     1       1.613   0.437   0.660  1.00  0.00           O  
HETATM   12  C   UNL     1       0.836  -0.241  -0.330  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.628   0.015  -0.081  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.972   0.710   0.852  1.00  0.00           O  
HETATM   15  N   UNL     1      -1.555  -0.528  -0.895  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.916  -0.371  -0.608  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.808  -1.398  -0.888  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.151  -1.240  -0.605  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.607  -0.061  -0.042  1.00  0.00           C  
HETATM   20 CL   UNL     1      -7.295   0.134   0.313  1.00  0.00          Cl  
HETATM   21  C   UNL     1      -4.719   0.964   0.238  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.375   0.809  -0.038  1.00  0.00           C  
HETATM   23  H   UNL     1       2.162   2.499  -0.720  1.00  0.00           H  
HETATM   24  H   UNL     1       3.506   2.614  -1.882  1.00  0.00           H  
HETATM   25  H   UNL     1       2.405   1.216  -1.930  1.00  0.00           H  
HETATM   26  H   UNL     1       3.795   2.759   1.167  1.00  0.00           H  
HETATM   27  H   UNL     1       5.178   1.647   1.301  1.00  0.00           H  
HETATM   28  H   UNL     1       5.134   2.859  -0.001  1.00  0.00           H  
HETATM   29  H   UNL     1       6.542  -1.082  -2.110  1.00  0.00           H  
HETATM   30  H   UNL     1       6.513  -2.295  -0.948  1.00  0.00           H  
HETATM   31  H   UNL     1       3.670  -2.027   2.738  1.00  0.00           H  
HETATM   32  H   UNL     1       2.401  -0.925   2.719  1.00  0.00           H  
HETATM   33  H   UNL     1       1.107   0.127  -1.319  1.00  0.00           H  
HETATM   34  H   UNL     1       1.033  -1.312  -0.274  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.278  -1.028  -1.679  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.453  -2.318  -1.328  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.845  -2.038  -0.822  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.078   1.883   0.677  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.682   1.607   0.185  1.00  0.00           H  
CONECT    1    2   23   24   25                                       
CONECT    2    3    4    1   10                                       
CONECT    3    2   26   27   28                                       
CONECT    4    2    5    5                                            
CONECT    5    4    4    6    7                                       
CONECT    6    5   29   30                                            
CONECT    7    5    8    8                                            
CONECT    8   10    7    7    9                                       
CONECT    9    8   31   32                                            
CONECT   10    2    8   11                                            
CONECT   11   12   10                                                 
CONECT   12   13   11   33   34                                       
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   35                                            
CONECT   16   17   15   22   22                                       
CONECT   17   18   18   16   36                                       
CONECT   18   17   17   19   37                                       
CONECT   19   18   20   21   21                                       
CONECT   20   19                                                      
CONECT   21   19   19   22   38                                       
CONECT   22   16   16   21   39                                       
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   15                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
