COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.011  -0.441   0.259  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.808   0.306   0.238  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.580  -0.396   0.298  1.00  0.00           C  
HETATM    4  N   UNL     1      -0.615  -1.719   0.371  1.00  0.00           N  
HETATM    5  N   UNL     1      -2.938  -1.780   0.330  1.00  0.00           N  
HETATM    6  N   UNL     1      -7.890   3.048  -1.278  1.00  0.00           N  
HETATM    7  C   UNL     1      -7.863   2.358   0.019  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.631   1.454   0.090  1.00  0.00           C  
HETATM    9  O   UNL     1      -5.449   2.256   0.065  1.00  0.00           O  
HETATM   10  C   UNL     1      -4.259   1.604   0.122  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.065   2.337   0.101  1.00  0.00           C  
HETATM   12  O   UNL     1      -3.110   3.694   0.025  1.00  0.00           O  
HETATM   13  C   UNL     1      -1.859   4.385   0.007  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.856   1.704   0.158  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.239   0.229   0.200  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.767  -2.383   0.389  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.735  -3.764   0.467  1.00  0.00           N  
HETATM   18  C   UNL     1      -3.099  -4.325   0.475  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.195  -5.313  -0.706  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.712  -5.684  -0.972  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.996  -4.342  -0.676  1.00  0.00           C  
HETATM   22  N   UNL     1       0.622   0.279   0.280  1.00  0.00           N  
HETATM   23  C   UNL     1       1.882  -0.466   0.343  1.00  0.00           C  
HETATM   24  C   UNL     1       3.057   0.514   0.307  1.00  0.00           C  
HETATM   25  C   UNL     1       4.372  -0.264   0.373  1.00  0.00           C  
HETATM   26  C   UNL     1       5.547   0.716   0.338  1.00  0.00           C  
HETATM   27  C   UNL     1       6.862  -0.062   0.404  1.00  0.00           C  
HETATM   28  N   UNL     1       7.990   0.878   0.370  1.00  0.00           N  
HETATM   29  C   UNL     1       8.104   1.521  -0.957  1.00  0.00           C  
HETATM   30  C   UNL     1       9.260   0.192   0.669  1.00  0.00           C  
HETATM   31  C   UNL     1      10.209   0.446  -0.521  1.00  0.00           C  
HETATM   32  C   UNL     1       9.624   1.730  -1.166  1.00  0.00           C  
HETATM   33  H   UNL     1      -8.695   3.651  -1.350  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.036   3.564  -1.430  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.821   3.094   0.821  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.764   1.753   0.127  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.658   0.875   1.014  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.628   0.775  -0.763  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.038   5.459  -0.056  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.308   4.162   0.921  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.278   4.062  -0.856  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.942   2.278   0.142  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.164  -0.329   0.215  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.279  -4.849   1.413  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.829  -3.525   0.349  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.768  -6.196  -0.424  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.637  -4.831  -1.578  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.376  -6.465  -0.290  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.565  -5.984  -2.010  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.056  -3.681  -1.540  1.00  0.00           H  
HETATM   51  H   UNL     1       0.045  -4.520  -0.404  1.00  0.00           H  
HETATM   52  H   UNL     1       0.634   1.248   0.225  1.00  0.00           H  
HETATM   53  H   UNL     1       1.918  -1.042   1.268  1.00  0.00           H  
HETATM   54  H   UNL     1       1.947  -1.142  -0.509  1.00  0.00           H  
HETATM   55  H   UNL     1       3.021   1.090  -0.617  1.00  0.00           H  
HETATM   56  H   UNL     1       2.991   1.190   1.160  1.00  0.00           H  
HETATM   57  H   UNL     1       4.408  -0.840   1.298  1.00  0.00           H  
HETATM   58  H   UNL     1       4.438  -0.941  -0.479  1.00  0.00           H  
HETATM   59  H   UNL     1       5.511   1.292  -0.587  1.00  0.00           H  
HETATM   60  H   UNL     1       5.482   1.392   1.190  1.00  0.00           H  
HETATM   61  H   UNL     1       6.898  -0.639   1.328  1.00  0.00           H  
HETATM   62  H   UNL     1       6.928  -0.739  -0.449  1.00  0.00           H  
HETATM   63  H   UNL     1       7.700   0.868  -1.731  1.00  0.00           H  
HETATM   64  H   UNL     1       7.583   2.479  -0.960  1.00  0.00           H  
HETATM   65  H   UNL     1       9.695   0.598   1.583  1.00  0.00           H  
HETATM   66  H   UNL     1       9.085  -0.877   0.785  1.00  0.00           H  
HETATM   67  H   UNL     1      11.227   0.619  -0.173  1.00  0.00           H  
HETATM   68  H   UNL     1      10.179  -0.388  -1.222  1.00  0.00           H  
HETATM   69  H   UNL     1       9.869   1.780  -2.227  1.00  0.00           H  
HETATM   70  H   UNL     1       9.972   2.622  -0.644  1.00  0.00           H  
CONECT    1    5    5    2   15                                       
CONECT    2    3    3    1   14                                       
CONECT    3    4   22    2    2                                       
CONECT    4   16   16    3                                            
CONECT    5   16    1    1                                            
CONECT    6    7   33   34                                            
CONECT    7    6    8   35   36                                       
CONECT    8    9    7   37   38                                       
CONECT    9   10    8                                                 
CONECT   10   15   15   11    9                                       
CONECT   11   14   14   10   12                                       
CONECT   12   11   13                                                 
CONECT   13   12   39   40   41                                       
CONECT   14    2   11   11   42                                       
CONECT   15    1   10   10   43                                       
CONECT   16   17    4    4    5                                       
CONECT   17   18   21   16                                            
CONECT   18   19   17   44   45                                       
CONECT   19   20   18   46   47                                       
CONECT   20   19   21   48   49                                       
CONECT   21   20   17   50   51                                       
CONECT   22   23    3   52                                            
CONECT   23   24   22   53   54                                       
CONECT   24   25   23   55   56                                       
CONECT   25   26   24   57   58                                       
CONECT   26   27   25   59   60                                       
CONECT   27   28   26   61   62                                       
CONECT   28   29   30   27                                            
CONECT   29   32   28   63   64                                       
CONECT   30   31   28   65   66                                       
CONECT   31   32   30   67   68                                       
CONECT   32   31   29   69   70                                       
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   29                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   32                                                      
CONECT   70   32                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
