COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.726   1.730   0.491  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.987  -0.562   0.286  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.712  -0.108  -0.067  1.00  0.00           C  
HETATM    4  C   UNL     1       2.571  -1.490  -0.975  1.00  0.00           C  
HETATM    5  C   UNL     1       3.714  -1.286  -0.015  1.00  0.00           C  
HETATM    6  C   UNL     1       4.369  -0.069   0.032  1.00  0.00           C  
HETATM    7  C   UNL     1       5.417   0.119   0.912  1.00  0.00           C  
HETATM    8  C   UNL     1       5.812  -0.911   1.748  1.00  0.00           C  
HETATM    9  C   UNL     1       5.156  -2.128   1.701  1.00  0.00           C  
HETATM   10  C   UNL     1       4.104  -2.313   0.824  1.00  0.00           C  
HETATM   11  C   UNL     1       2.492   3.481  -0.951  1.00  0.00           C  
HETATM   12  C   UNL     1       2.561   5.009  -0.970  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.981   0.356   0.562  1.00  0.00           C  
HETATM   14  C   UNL     1       3.065  -1.281  -2.408  1.00  0.00           C  
HETATM   15  C   UNL     1       1.905  -1.489  -3.383  1.00  0.00           C  
HETATM   16  C   UNL     1       1.361  -2.911  -3.233  1.00  0.00           C  
HETATM   17  C   UNL     1       0.866  -3.120  -1.800  1.00  0.00           C  
HETATM   18  C   UNL     1       2.027  -2.913  -0.825  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.157   1.039   1.165  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.485   0.513   1.722  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.463   1.286  -0.135  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.491   2.193   0.150  1.00  0.00           C  
HETATM   23  C   UNL     1       0.836   1.715  -0.494  1.00  0.00           C  
HETATM   24  N   UNL     1       1.755   0.792  -0.748  1.00  0.00           N  
HETATM   25  N   UNL     1       1.140   3.058  -0.578  1.00  0.00           N  
HETATM   26  N   UNL     1       0.291  -0.956  -0.344  1.00  0.00           N  
HETATM   27  C   UNL     1       1.477  -0.500  -0.672  1.00  0.00           C  
HETATM   28  N   UNL     1       3.917   5.433  -1.344  1.00  0.00           N  
HETATM   29  N   UNL     1      -4.253  -0.091   0.914  1.00  0.00           N  
HETATM   30 CL   UNL     1       7.129  -0.676   2.854  1.00  0.00          Cl  
HETATM   31  N   UNL     1      -7.007  -0.508   0.801  1.00  0.00           N  
HETATM   32  C   UNL     1      -6.111  -1.601   0.394  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.797  -0.992  -0.111  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.273  -0.443   0.343  1.00  0.00           C  
HETATM   35  O   UNL     1      -8.657  -1.236  -0.491  1.00  0.00           O  
HETATM   36  C   UNL     1      -9.211   0.613   0.866  1.00  0.00           C  
HETATM   37  H   UNL     1      -3.518   2.431   0.706  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.192  -1.621   0.342  1.00  0.00           H  
HETATM   39  H   UNL     1       4.061   0.735  -0.621  1.00  0.00           H  
HETATM   40  H   UNL     1       5.928   1.069   0.948  1.00  0.00           H  
HETATM   41  H   UNL     1       5.464  -2.933   2.353  1.00  0.00           H  
HETATM   42  H   UNL     1       3.593  -3.264   0.787  1.00  0.00           H  
HETATM   43  H   UNL     1       2.733   3.094  -1.941  1.00  0.00           H  
HETATM   44  H   UNL     1       3.207   3.094  -0.225  1.00  0.00           H  
HETATM   45  H   UNL     1       1.846   5.396  -1.696  1.00  0.00           H  
HETATM   46  H   UNL     1       2.320   5.396   0.020  1.00  0.00           H  
HETATM   47  H   UNL     1       3.453  -0.268  -2.515  1.00  0.00           H  
HETATM   48  H   UNL     1       3.856  -1.998  -2.627  1.00  0.00           H  
HETATM   49  H   UNL     1       1.113  -0.772  -3.164  1.00  0.00           H  
HETATM   50  H   UNL     1       2.257  -1.340  -4.404  1.00  0.00           H  
HETATM   51  H   UNL     1       0.534  -3.059  -3.928  1.00  0.00           H  
HETATM   52  H   UNL     1       2.152  -3.628  -3.453  1.00  0.00           H  
HETATM   53  H   UNL     1       0.075  -2.403  -1.581  1.00  0.00           H  
HETATM   54  H   UNL     1       0.479  -4.133  -1.694  1.00  0.00           H  
HETATM   55  H   UNL     1       2.819  -3.629  -1.045  1.00  0.00           H  
HETATM   56  H   UNL     1       1.675  -3.061   0.196  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.341   1.572   0.233  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.702   1.715   1.888  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.319   0.070   2.704  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.197   1.334   1.806  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.306   3.256   0.099  1.00  0.00           H  
HETATM   62  H   UNL     1       0.459   3.722  -0.389  1.00  0.00           H  
HETATM   63  H   UNL     1       3.988   6.440  -1.364  1.00  0.00           H  
HETATM   64  H   UNL     1       4.605   5.034  -0.724  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.910  -2.247   1.248  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.577  -2.178  -0.404  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.985  -0.429  -1.026  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.081  -1.788  -0.314  1.00  0.00           H  
HETATM   69  H   UNL     1      -9.196   1.475   0.198  1.00  0.00           H  
HETATM   70  H   UNL     1     -10.222   0.209   0.916  1.00  0.00           H  
HETATM   71  H   UNL     1      -8.892   0.921   1.862  1.00  0.00           H  
CONECT    1   13   13   22   37                                       
CONECT    2   13    3    3   38                                       
CONECT    3    2    2   21   26                                       
CONECT    4    5   27   18   14                                       
CONECT    5   10   10    6    4                                       
CONECT    6    7    7    5   39                                       
CONECT    7    8    6    6   40                                       
CONECT    8   30    9    9    7                                       
CONECT    9    8    8   10   41                                       
CONECT   10    9    5    5   42                                       
CONECT   11   25   12   43   44                                       
CONECT   12   11   28   45   46                                       
CONECT   13   29    1    1    2                                       
CONECT   14    4   15   47   48                                       
CONECT   15   14   16   49   50                                       
CONECT   16   17   15   51   52                                       
CONECT   17   18   16   53   54                                       
CONECT   18    4   17   55   56                                       
CONECT   19   20   29   57   58                                       
CONECT   20   31   19   59   60                                       
CONECT   21   22   22    3   23                                       
CONECT   22    1   21   21   61                                       
CONECT   23   21   25   24   24                                       
CONECT   24   23   23   27                                            
CONECT   25   23   11   62                                            
CONECT   26    3   27   27                                            
CONECT   27   26   26   24    4                                       
CONECT   28   12   63   64                                            
CONECT   29   33   13   19                                            
CONECT   30    8                                                      
CONECT   31   32   20   34                                            
CONECT   32   31   33   65   66                                       
CONECT   33   32   29   67   68                                       
CONECT   34   31   36   35   35                                       
CONECT   35   34   34                                                 
CONECT   36   34   69   70   71                                       
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   20                                                      
CONECT   61   22                                                      
CONECT   62   25                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   32                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   33                                                      
CONECT   69   36                                                      
CONECT   70   36                                                      
CONECT   71   36                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
