COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.173   1.021   0.524  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.220   1.005   0.451  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.352   1.423   0.466  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.321  -0.802  -0.221  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.641  -0.103  -0.020  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.193   0.675  -1.027  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.405   1.301  -0.806  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.542   0.430   1.322  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.334  -0.226   1.174  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.884  -0.176   0.080  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.146  -1.333  -0.215  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.838  -2.574  -0.606  1.00  0.00           C  
HETATM   13  C   UNL     1       1.244  -1.301  -0.138  1.00  0.00           C  
HETATM   14  C   UNL     1       7.650  -0.031   0.535  1.00  0.00           C  
HETATM   15  C   UNL     1       6.145  -0.055   0.453  1.00  0.00           C  
HETATM   16  C   UNL     1       5.478   0.931  -0.250  1.00  0.00           C  
HETATM   17  C   UNL     1       4.099   0.914  -0.328  1.00  0.00           C  
HETATM   18  C   UNL     1       3.381  -0.101   0.304  1.00  0.00           C  
HETATM   19  C   UNL     1       4.059  -1.091   1.010  1.00  0.00           C  
HETATM   20  C   UNL     1       5.438  -1.067   1.077  1.00  0.00           C  
HETATM   21  C   UNL     1       1.899  -0.125   0.224  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.178   1.943   0.673  1.00  0.00           N  
HETATM   23  N   UNL     1      -2.227   0.118   0.098  1.00  0.00           N  
HETATM   24  N   UNL     1      -7.034   1.166   0.345  1.00  0.00           N  
HETATM   25  O   UNL     1      -2.040  -2.570  -0.784  1.00  0.00           O  
HETATM   26  O   UNL     1      -0.137  -3.714  -0.767  1.00  0.00           O  
HETATM   27 CL   UNL     1       3.261   2.153  -1.210  1.00  0.00          Cl  
HETATM   28  H   UNL     1       1.688   1.927   0.809  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.290   1.949   0.571  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.267  -1.672   0.435  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.235  -1.124  -1.259  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.681   0.790  -1.971  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.841   1.908  -1.585  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.089   0.339   2.249  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.937  -0.827   1.979  1.00  0.00           H  
HETATM   36  H   UNL     1       1.817  -2.189  -0.364  1.00  0.00           H  
HETATM   37  H   UNL     1       7.957   0.545   1.407  1.00  0.00           H  
HETATM   38  H   UNL     1       8.025  -1.051   0.622  1.00  0.00           H  
HETATM   39  H   UNL     1       8.055   0.430  -0.366  1.00  0.00           H  
HETATM   40  H   UNL     1       6.036   1.716  -0.739  1.00  0.00           H  
HETATM   41  H   UNL     1       3.508  -1.879   1.502  1.00  0.00           H  
HETATM   42  H   UNL     1       5.964  -1.837   1.621  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.635  -4.503  -1.023  1.00  0.00           H  
CONECT    1   21   21    2   28                                       
CONECT    2    1   22   10   10                                       
CONECT    3   22   22   23   29                                       
CONECT    4   23    5   30   31                                       
CONECT    5    4    6    6    9                                       
CONECT    6    5    5    7   32                                       
CONECT    7    6   24   24   33                                       
CONECT    8   24    9    9   34                                       
CONECT    9    5    8    8   35                                       
CONECT   10    2    2   23   11                                       
CONECT   11   10   12   13   13                                       
CONECT   12   11   25   25   26                                       
CONECT   13   21   11   11   36                                       
CONECT   14   15   37   38   39                                       
CONECT   15   14   16   16   20                                       
CONECT   16   15   15   17   40                                       
CONECT   17   16   27   18   18                                       
CONECT   18   17   17   19   21                                       
CONECT   19   18   20   20   41                                       
CONECT   20   15   19   19   42                                       
CONECT   21   18    1    1   13                                       
CONECT   22    2    3    3                                            
CONECT   23    3    4   10                                            
CONECT   24    7    7    8                                            
CONECT   25   12   12                                                 
CONECT   26   12   43                                                 
CONECT   27   17                                                      
CONECT   28    1                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   26                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
