COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -8.591   0.622  -0.332  1.00  0.00           C  
HETATM    2  O   UNL     1      -6.592  -0.906   0.472  1.00  0.00           O  
HETATM    3  C   UNL     1      -6.200   0.083  -0.110  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.494  -0.216  -0.075  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.488  -1.232   0.471  1.00  0.00           C  
HETATM    6  C   UNL     1       0.872  -1.735   0.673  1.00  0.00           C  
HETATM    7  C   UNL     1       2.256  -1.242   0.339  1.00  0.00           C  
HETATM    8  C   UNL     1       2.849  -1.609  -0.856  1.00  0.00           C  
HETATM    9  C   UNL     1       4.116  -1.160  -1.168  1.00  0.00           C  
HETATM   10  C   UNL     1       4.800  -0.336  -0.277  1.00  0.00           C  
HETATM   11  C   UNL     1       4.198   0.031   0.927  1.00  0.00           C  
HETATM   12  C   UNL     1       6.163   0.149  -0.607  1.00  0.00           C  
HETATM   13  C   UNL     1       7.140  -0.748  -1.031  1.00  0.00           C  
HETATM   14  C   UNL     1       8.706   1.054  -1.222  1.00  0.00           C  
HETATM   15  C   UNL     1       7.737   1.950  -0.806  1.00  0.00           C  
HETATM   16  C   UNL     1       6.468   1.504  -0.498  1.00  0.00           C  
HETATM   17 CL   UNL     1       5.042   1.058   2.043  1.00  0.00          Cl  
HETATM   18  C   UNL     1       8.406  -0.292  -1.337  1.00  0.00           C  
HETATM   19  C   UNL     1       2.927  -0.420   1.226  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.123  -0.783   0.163  1.00  0.00           N  
HETATM   21  C   UNL     1      -3.915  -0.684   0.246  1.00  0.00           C  
HETATM   22  N   UNL     1      -4.879   0.288  -0.277  1.00  0.00           N  
HETATM   23  C   UNL     1      -7.192   1.083  -0.648  1.00  0.00           C  
HETATM   24  O   UNL     1      -8.766  -0.412   0.268  1.00  0.00           O  
HETATM   25  O   UNL     1      -9.644   1.363  -0.712  1.00  0.00           O  
HETATM   26  C   UNL     1     -10.962   0.862  -0.369  1.00  0.00           C  
HETATM   27  H   UNL     1      -2.318   0.755   0.388  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.375  -0.131  -1.155  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.607  -1.317   1.551  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.664  -2.203   0.008  1.00  0.00           H  
HETATM   31  H   UNL     1       0.712  -2.710   0.212  1.00  0.00           H  
HETATM   32  H   UNL     1       0.769  -1.824   1.755  1.00  0.00           H  
HETATM   33  H   UNL     1       2.318  -2.248  -1.546  1.00  0.00           H  
HETATM   34  H   UNL     1       4.577  -1.448  -2.101  1.00  0.00           H  
HETATM   35  H   UNL     1       6.908  -1.799  -1.121  1.00  0.00           H  
HETATM   36  H   UNL     1       9.698   1.407  -1.462  1.00  0.00           H  
HETATM   37  H   UNL     1       7.975   3.000  -0.722  1.00  0.00           H  
HETATM   38  H   UNL     1       5.713   2.205  -0.174  1.00  0.00           H  
HETATM   39  H   UNL     1       9.165  -0.987  -1.666  1.00  0.00           H  
HETATM   40  H   UNL     1       2.458  -0.133   2.155  1.00  0.00           H  
HETATM   41  H   UNL     1       0.043   0.144   0.526  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.091  -1.655  -0.217  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.035  -0.769   1.326  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.566   1.079  -0.742  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.072   1.168  -1.728  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.016   2.054  -0.185  1.00  0.00           H  
HETATM   47  H   UNL     1     -11.110  -0.115  -0.829  1.00  0.00           H  
HETATM   48  H   UNL     1     -11.045   0.769   0.714  1.00  0.00           H  
HETATM   49  H   UNL     1     -11.721   1.554  -0.733  1.00  0.00           H  
CONECT    1   25   23   24   24                                       
CONECT    2    3    3                                                 
CONECT    3   22    2    2   23                                       
CONECT    4    5   21   27   28                                       
CONECT    5   20    4   29   30                                       
CONECT    6    7   20   31   32                                       
CONECT    7    8    6   19   19                                       
CONECT    8    9    9    7   33                                       
CONECT    9    8    8   10   34                                       
CONECT   10    9   12   11   11                                       
CONECT   11   10   10   17   19                                       
CONECT   12   13   10   16   16                                       
CONECT   13   18   18   12   35                                       
CONECT   14   18   15   15   36                                       
CONECT   15   14   14   16   37                                       
CONECT   16   12   12   15   38                                       
CONECT   17   11                                                      
CONECT   18   13   13   14   39                                       
CONECT   19    7    7   11   40                                       
CONECT   20    6    5   41                                            
CONECT   21    4   22   42   43                                       
CONECT   22   21    3   44                                            
CONECT   23    3    1   45   46                                       
CONECT   24    1    1                                                 
CONECT   25   26    1                                                 
CONECT   26   25   47   48   49                                       
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
