COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.777   0.376  -0.812  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.215   0.462  -1.104  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.010   0.161   0.140  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.448   0.366   1.386  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.177   0.090   2.528  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.468  -0.393   2.423  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.303  -0.317   0.036  1.00  0.00           C  
HETATM    8  C   UNL     1       1.966   0.460   0.250  1.00  0.00           C  
HETATM    9  C   UNL     1       4.093  -0.644   0.106  1.00  0.00           C  
HETATM   10  C   UNL     1       2.104  -1.832  -0.523  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.501   1.905  -1.573  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.112   2.394  -2.060  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.166   1.696  -1.052  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.030  -0.598   1.177  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.918  -0.535  -1.322  1.00  0.00           C  
HETATM   16  C   UNL     1       1.336  -0.698  -0.218  1.00  0.00           C  
HETATM   17  C   UNL     1       3.333   0.483   0.410  1.00  0.00           C  
HETATM   18  C   UNL     1       3.478  -1.797  -0.358  1.00  0.00           C  
HETATM   19  O   UNL     1       1.501  -2.960  -0.977  1.00  0.00           O  
HETATM   20  O   UNL     1       5.440  -0.614   0.266  1.00  0.00           O  
HETATM   21  C   UNL     1      -0.126  -0.727  -0.390  1.00  0.00           C  
HETATM   22  O   UNL     1      -0.747  -1.745  -0.151  1.00  0.00           O  
HETATM   23 CL   UNL     1       4.112   1.921   0.991  1.00  0.00          Cl  
HETATM   24  H   UNL     1      -2.477  -0.244  -1.891  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.439   0.743   1.468  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.737   0.250   3.501  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.037  -0.610   3.315  1.00  0.00           H  
HETATM   28  H   UNL     1       1.380   1.337   0.482  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.220   1.908  -2.392  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.857   2.516  -0.743  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.914   2.059  -3.078  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.031   3.478  -1.984  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.114   2.264  -0.123  1.00  0.00           H  
HETATM   34  H   UNL     1       0.829   1.580  -1.482  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.039  -0.975   1.096  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.710  -1.552  -1.656  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.996  -0.387  -1.261  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.493   0.174  -2.032  1.00  0.00           H  
HETATM   39  H   UNL     1       4.072  -2.668  -0.593  1.00  0.00           H  
HETATM   40  H   UNL     1       1.418  -3.001  -1.940  1.00  0.00           H  
HETATM   41  H   UNL     1       5.739  -0.891   1.143  1.00  0.00           H  
CONECT    1    2   13   21                                            
CONECT    2    1    3   11   24                                       
CONECT    3    2    4    4    7                                       
CONECT    4    3    3    5   25                                       
CONECT    5    4    6    6   26                                       
CONECT    6    5    5   14   27                                       
CONECT    7    3   14   14   15                                       
CONECT    8   16   16   17   28                                       
CONECT    9   17   17   18   20                                       
CONECT   10   16   18   18   19                                       
CONECT   11    2   12   29   30                                       
CONECT   12   11   13   31   32                                       
CONECT   13    1   12   33   34                                       
CONECT   14    6    7    7   35                                       
CONECT   15    7   36   37   38                                       
CONECT   16    8    8   10   21                                       
CONECT   17    8    9    9   23                                       
CONECT   18    9   10   10   39                                       
CONECT   19   10   40                                                 
CONECT   20    9   41                                                 
CONECT   21    1   16   22   22                                       
CONECT   22   21   21                                                 
CONECT   23   17                                                      
CONECT   24    2                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    8                                                      
CONECT   29   11                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
