COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.029   0.884  -0.007  1.00  0.00           C  
HETATM    2  C   UNL     1       3.030  -0.085   0.891  1.00  0.00           C  
HETATM    3  C   UNL     1       3.820   1.024   0.652  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.401   1.011  -2.218  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.705   1.184  -1.788  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.008   1.130  -0.440  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.011   0.901   0.486  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.694   0.725   0.060  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.395   0.782  -1.303  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.621   0.481   1.046  1.00  0.00           C  
HETATM   11  N   UNL     1       0.650   0.311   0.631  1.00  0.00           N  
HETATM   12  O   UNL     1      -0.884   0.433   2.232  1.00  0.00           O  
HETATM   13  C   UNL     1       1.714   0.069   1.609  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.431   1.321   0.019  1.00  0.00           C  
HETATM   15  N   UNL     1      -6.108   0.023   0.065  1.00  0.00           N  
HETATM   16  C   UNL     1      -6.163  -0.827   1.136  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.881  -1.898   0.747  1.00  0.00           C  
HETATM   18  N   UNL     1      -7.253  -1.708  -0.527  1.00  0.00           N  
HETATM   19  C   UNL     1      -6.799  -0.556  -0.941  1.00  0.00           C  
HETATM   20  C   UNL     1       3.447  -1.334   0.473  1.00  0.00           C  
HETATM   21  C   UNL     1       4.650  -1.474  -0.196  1.00  0.00           C  
HETATM   22  C   UNL     1       5.444  -0.366  -0.431  1.00  0.00           C  
HETATM   23 CL   UNL     1       6.021   2.276  -0.308  1.00  0.00          Cl  
HETATM   24 CL   UNL     1       5.174  -3.044  -0.721  1.00  0.00          Cl  
HETATM   25  H   UNL     1       3.494   2.000   0.979  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.171   1.050  -3.272  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.489   1.363  -2.509  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.249   0.859   1.539  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.378   0.642  -1.639  1.00  0.00           H  
HETATM   30  H   UNL     1       0.861   0.350  -0.315  1.00  0.00           H  
HETATM   31  H   UNL     1       1.495  -0.842   2.166  1.00  0.00           H  
HETATM   32  H   UNL     1       1.773   0.911   2.299  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.435   1.768   1.013  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.952   1.979  -0.677  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.717  -0.670   2.107  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.115  -2.760   1.354  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.945  -0.139  -1.926  1.00  0.00           H  
HETATM   38  H   UNL     1       2.830  -2.200   0.660  1.00  0.00           H  
HETATM   39  H   UNL     1       6.387  -0.476  -0.946  1.00  0.00           H  
CONECT    1   22   22    3   23                                       
CONECT    2   20   13    3    3                                       
CONECT    3    2    2    1   25                                       
CONECT    4    5    9    9   26                                       
CONECT    5    6    6    4   27                                       
CONECT    6   14    5    5    7                                       
CONECT    7    6    8    8   28                                       
CONECT    8    7    7    9   10                                       
CONECT    9    4    4    8   29                                       
CONECT   10    8   12   12   11                                       
CONECT   11   10   13   30                                            
CONECT   12   10   10                                                 
CONECT   13   11    2   31   32                                       
CONECT   14   15    6   33   34                                       
CONECT   15   19   16   14                                            
CONECT   16   17   17   15   35                                       
CONECT   17   18   16   16   36                                       
CONECT   18   17   19   19                                            
CONECT   19   18   18   15   37                                       
CONECT   20   21   21    2   38                                       
CONECT   21   24   20   20   22                                       
CONECT   22   21    1    1   39                                       
CONECT   23    1                                                      
CONECT   24   21                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    7                                                      
CONECT   29    9                                                      
CONECT   30   11                                                      
CONECT   31   13                                                      
CONECT   32   13                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   22                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
