COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.537   2.042  -0.145  1.00  0.00           C  
HETATM    2  C   UNL     1       1.260   3.249  -0.220  1.00  0.00           C  
HETATM    3  C   UNL     1       2.563   3.310   0.224  1.00  0.00           C  
HETATM    4  O   UNL     1       0.669   4.358  -0.734  1.00  0.00           O  
HETATM    5  C   UNL     1       2.455   0.962   0.829  1.00  0.00           C  
HETATM    6  C   UNL     1       3.174   2.174   0.751  1.00  0.00           C  
HETATM    7  C   UNL     1       3.366  -0.016   1.420  1.00  0.00           C  
HETATM    8  C   UNL     1       3.053  -1.462   1.705  1.00  0.00           C  
HETATM    9  C   UNL     1       3.408  -2.299   0.504  1.00  0.00           C  
HETATM   10  C   UNL     1       2.468  -2.525  -0.484  1.00  0.00           C  
HETATM   11  C   UNL     1       2.795  -3.289  -1.589  1.00  0.00           C  
HETATM   12  C   UNL     1       4.677  -2.837   0.386  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.319  -0.067  -1.808  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.609   1.009  -2.001  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.185   0.910  -0.059  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.026   0.213   0.788  1.00  0.00           C  
HETATM   17  C   UNL     1       1.136   0.903   0.380  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.859   1.989  -0.618  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.251   1.005  -1.451  1.00  0.00           N  
HETATM   20  O   UNL     1      -1.656   2.833  -0.255  1.00  0.00           O  
HETATM   21  N   UNL     1       4.420   1.925   1.260  1.00  0.00           N  
HETATM   22  N   UNL     1       4.496   0.586   1.655  1.00  0.00           N  
HETATM   23  C   UNL     1       4.064  -3.826  -1.706  1.00  0.00           C  
HETATM   24  C   UNL     1       5.003  -3.604  -0.716  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.526   0.248  -1.078  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.208  -1.148   0.615  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.549  -1.810  -0.405  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.708  -1.111  -1.251  1.00  0.00           C  
HETATM   29 CL   UNL     1      -6.264  -2.024   1.679  1.00  0.00          Cl  
HETATM   30  H   UNL     1       3.111   4.238   0.163  1.00  0.00           H  
HETATM   31  H   UNL     1       0.213   4.900  -0.077  1.00  0.00           H  
HETATM   32  H   UNL     1       3.633  -1.796   2.565  1.00  0.00           H  
HETATM   33  H   UNL     1       1.990  -1.568   1.921  1.00  0.00           H  
HETATM   34  H   UNL     1       1.477  -2.105  -0.392  1.00  0.00           H  
HETATM   35  H   UNL     1       2.060  -3.466  -2.360  1.00  0.00           H  
HETATM   36  H   UNL     1       5.413  -2.656   1.156  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.348  -0.843  -1.043  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.606  -0.493  -2.770  1.00  0.00           H  
HETATM   39  H   UNL     1       0.691   0.337  -1.878  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.960   2.036  -2.096  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.605   0.534  -2.982  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.046   1.973   0.073  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.540   0.730   1.584  1.00  0.00           H  
HETATM   44  H   UNL     1       0.584  -0.023   0.438  1.00  0.00           H  
HETATM   45  H   UNL     1       5.136   2.575   1.336  1.00  0.00           H  
HETATM   46  H   UNL     1       4.319  -4.423  -2.569  1.00  0.00           H  
HETATM   47  H   UNL     1       5.994  -4.024  -0.808  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.691  -2.872  -0.541  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.193  -1.628  -2.048  1.00  0.00           H  
CONECT    1   18   17   17    2                                       
CONECT    2    1    4    3    3                                       
CONECT    3    2    2    6   30                                       
CONECT    4    2   31                                                 
CONECT    5   17    6    6    7                                       
CONECT    6    5    5    3   21                                       
CONECT    7    5    8   22   22                                       
CONECT    8    9    7   32   33                                       
CONECT    9   10   10   12    8                                       
CONECT   10   11    9    9   34                                       
CONECT   11   23   23   10   35                                       
CONECT   12   24   24    9   36                                       
CONECT   13   19   37   38   39                                       
CONECT   14   19   25   40   41                                       
CONECT   15   16   16   25   42                                       
CONECT   16   15   15   26   43                                       
CONECT   17    1    1    5   44                                       
CONECT   18   20   20   19    1                                       
CONECT   19   13   18   14                                            
CONECT   20   18   18                                                 
CONECT   21    6   22   45                                            
CONECT   22    7    7   21                                            
CONECT   23   11   11   24   46                                       
CONECT   24   23   12   12   47                                       
CONECT   25   15   14   28   28                                       
CONECT   26   16   29   27   27                                       
CONECT   27   26   26   28   48                                       
CONECT   28   25   25   27   49                                       
CONECT   29   26                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
