COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -5.987  -0.238  -1.300  1.00  0.00          Cl  
HETATM    2  C   UNL     1      -4.320  -0.106  -0.834  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.362  -0.869  -1.479  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.034  -0.770  -1.115  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.664   0.101  -0.096  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.635   0.868   0.553  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.955   0.767   0.180  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.252   0.240   0.324  1.00  0.00           C  
HETATM    9  N   UNL     1       0.025   0.762   1.483  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.020   1.196   2.405  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.444   2.243   3.360  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.505  -0.008   3.215  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.204   1.802   1.653  1.00  0.00           C  
HETATM   14  N   UNL     1       0.763  -0.181  -0.507  1.00  0.00           N  
HETATM   15  C   UNL     1       2.160  -0.040  -0.086  1.00  0.00           C  
HETATM   16  C   UNL     1       2.651   1.343  -0.426  1.00  0.00           C  
HETATM   17  N   UNL     1       2.308   2.052  -1.482  1.00  0.00           N  
HETATM   18  C   UNL     1       2.980   3.211  -1.379  1.00  0.00           C  
HETATM   19  O   UNL     1       2.939   4.146  -2.160  1.00  0.00           O  
HETATM   20  O   UNL     1       3.704   3.142  -0.252  1.00  0.00           O  
HETATM   21  N   UNL     1       3.508   2.075   0.292  1.00  0.00           N  
HETATM   22  C   UNL     1       3.018  -1.079  -0.812  1.00  0.00           C  
HETATM   23  C   UNL     1       2.608  -2.462  -0.378  1.00  0.00           C  
HETATM   24  C   UNL     1       1.618  -3.138  -1.067  1.00  0.00           C  
HETATM   25  C   UNL     1       1.241  -4.407  -0.668  1.00  0.00           C  
HETATM   26  C   UNL     1       1.855  -5.000   0.419  1.00  0.00           C  
HETATM   27  C   UNL     1       2.844  -4.324   1.109  1.00  0.00           C  
HETATM   28  C   UNL     1       3.225  -3.057   0.706  1.00  0.00           C  
HETATM   29  H   UNL     1      -3.655  -1.544  -2.270  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.286  -1.366  -1.619  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.706   1.362   0.678  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.083   3.098   2.787  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.220   2.571   4.051  1.00  0.00           H  
HETATM   34  H   UNL     1       0.382   1.808   3.921  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.670  -0.427   3.778  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.286   0.309   3.906  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.903  -0.765   2.539  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.909   2.759   1.223  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.033   1.956   2.345  1.00  0.00           H  
HETATM   40  H   UNL     1       0.554  -0.570  -1.370  1.00  0.00           H  
HETATM   41  H   UNL     1       2.233  -0.198   0.990  1.00  0.00           H  
HETATM   42  H   UNL     1       3.919   1.792   1.124  1.00  0.00           H  
HETATM   43  H   UNL     1       2.876  -0.979  -1.888  1.00  0.00           H  
HETATM   44  H   UNL     1       4.068  -0.917  -0.567  1.00  0.00           H  
HETATM   45  H   UNL     1       1.138  -2.674  -1.916  1.00  0.00           H  
HETATM   46  H   UNL     1       0.468  -4.935  -1.206  1.00  0.00           H  
HETATM   47  H   UNL     1       1.560  -5.991   0.731  1.00  0.00           H  
HETATM   48  H   UNL     1       3.323  -4.787   1.959  1.00  0.00           H  
HETATM   49  H   UNL     1       4.001  -2.531   1.242  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3    7                                       
CONECT    3    2    2    4   29                                       
CONECT    4    3    5    5   30                                       
CONECT    5    4    4    6    8                                       
CONECT    6    7    7    5   13                                       
CONECT    7    2    6    6   31                                       
CONECT    8    5   14    9    9                                       
CONECT    9    8    8   10                                            
CONECT   10   13    9   12   11                                       
CONECT   11   10   32   33   34                                       
CONECT   12   10   35   36   37                                       
CONECT   13    6   10   38   39                                       
CONECT   14    8   15   40                                            
CONECT   15   14   16   22   41                                       
CONECT   16   21   17   17   15                                       
CONECT   17   18   16   16                                            
CONECT   18   20   19   19   17                                       
CONECT   19   18   18                                                 
CONECT   20   21   18                                                 
CONECT   21   20   16   42                                            
CONECT   22   15   23   43   44                                       
CONECT   23   22   28   28   24                                       
CONECT   24   23   25   25   45                                       
CONECT   25   24   24   26   46                                       
CONECT   26   27   27   25   47                                       
CONECT   27   28   26   26   48                                       
CONECT   28   23   23   27   49                                       
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    7                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
