COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.098  -1.539  -0.563  1.00  0.00           N  
HETATM    2  N   UNL     1      -4.194   1.508   1.867  1.00  0.00           N  
HETATM    3  C   UNL     1       3.022   0.685  -0.141  1.00  0.00           C  
HETATM    4  C   UNL     1       4.008   1.486   0.414  1.00  0.00           C  
HETATM    5  C   UNL     1       3.766   2.823   0.657  1.00  0.00           C  
HETATM    6  C   UNL     1       2.534   3.368   0.345  1.00  0.00           C  
HETATM    7  C   UNL     1       1.550   2.570  -0.207  1.00  0.00           C  
HETATM    8  C   UNL     1       0.695   0.390  -1.045  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.386   0.128  -0.026  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.068   1.563   1.172  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.814  -0.522   0.846  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.249  -2.558  -0.951  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.354  -1.539  -0.820  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.618  -0.500   0.082  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.238  -0.466   1.020  1.00  0.00           O  
HETATM   16  N   UNL     1      -1.536   0.660  -0.463  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.731   0.583   0.263  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.424  -2.581  -0.203  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.713  -1.588   0.683  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.060   0.529   1.744  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.448   1.270  -1.652  1.00  0.00           C  
HETATM   22  O   UNL     1      -2.363   1.817  -2.230  1.00  0.00           O  
HETATM   23  C   UNL     1      -0.025   1.171  -2.158  1.00  0.00           C  
HETATM   24  C   UNL     1       1.791   1.227  -0.449  1.00  0.00           C  
HETATM   25 CL   UNL     1       2.224   5.049   0.645  1.00  0.00          Cl  
HETATM   26  C   UNL     1       3.333  -0.767  -0.394  1.00  0.00           C  
HETATM   27  C   UNL     1       1.245  -0.922  -1.593  1.00  0.00           C  
HETATM   28  C   UNL     1       2.393  -2.939  -0.893  1.00  0.00           C  
HETATM   29  C   UNL     1       3.071  -3.600   0.279  1.00  0.00           C  
HETATM   30  O   UNL     1       3.287  -2.967   1.291  1.00  0.00           O  
HETATM   31  N   UNL     1       3.437  -4.895   0.204  1.00  0.00           N  
HETATM   32  C   UNL     1       4.096  -5.537   1.344  1.00  0.00           C  
HETATM   33  H   UNL     1       4.971   1.062   0.658  1.00  0.00           H  
HETATM   34  H   UNL     1       4.538   3.443   1.091  1.00  0.00           H  
HETATM   35  H   UNL     1       0.587   2.995  -0.450  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.398   2.397   1.320  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.045  -3.359  -1.646  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.447  -1.533  -1.406  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.117  -3.400  -0.326  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.628  -1.620   1.257  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.964   0.531   2.335  1.00  0.00           H  
HETATM   42  H   UNL     1       0.412   2.163  -2.275  1.00  0.00           H  
HETATM   43  H   UNL     1       0.011   0.621  -3.098  1.00  0.00           H  
HETATM   44  H   UNL     1       3.893  -1.167   0.451  1.00  0.00           H  
HETATM   45  H   UNL     1       3.936  -0.854  -1.297  1.00  0.00           H  
HETATM   46  H   UNL     1       1.836  -0.726  -2.488  1.00  0.00           H  
HETATM   47  H   UNL     1       0.420  -1.592  -1.835  1.00  0.00           H  
HETATM   48  H   UNL     1       1.464  -3.463  -1.118  1.00  0.00           H  
HETATM   49  H   UNL     1       3.050  -2.977  -1.762  1.00  0.00           H  
HETATM   50  H   UNL     1       3.264  -5.402  -0.605  1.00  0.00           H  
HETATM   51  H   UNL     1       4.315  -6.576   1.099  1.00  0.00           H  
HETATM   52  H   UNL     1       5.025  -5.013   1.569  1.00  0.00           H  
HETATM   53  H   UNL     1       3.438  -5.500   2.212  1.00  0.00           H  
CONECT    1   27   28   26                                            
CONECT    2   20   10   10                                            
CONECT    3   24   26    4    4                                       
CONECT    4    3    3    5   33                                       
CONECT    5    6    6    4   34                                       
CONECT    6    7   25    5    5                                       
CONECT    7   24   24    6   35                                       
CONECT    8   23    9   27   24                                       
CONECT    9   16    8   15   15                                       
CONECT   10    2    2   17   36                                       
CONECT   11   19   20   20   14                                       
CONECT   12   18   13   13   37                                       
CONECT   13   12   12   14   38                                       
CONECT   14   11   13   17   17                                       
CONECT   15    9    9                                                 
CONECT   16   21   17    9                                            
CONECT   17   14   14   10   16                                       
CONECT   18   19   19   12   39                                       
CONECT   19   18   18   11   40                                       
CONECT   20   11   11    2   41                                       
CONECT   21   22   22   16   23                                       
CONECT   22   21   21                                                 
CONECT   23   21    8   42   43                                       
CONECT   24    8    7    7    3                                       
CONECT   25    6                                                      
CONECT   26    1    3   44   45                                       
CONECT   27    8    1   46   47                                       
CONECT   28   29    1   48   49                                       
CONECT   29   30   30   31   28                                       
CONECT   30   29   29                                                 
CONECT   31   32   29   50                                            
CONECT   32   31   51   52   53                                       
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   26                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   31                                                      
CONECT   51   32                                                      
CONECT   52   32                                                      
CONECT   53   32                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
