COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.249   1.007  -0.761  1.00  0.00           N  
HETATM    2  C   UNL     1       5.345   1.897  -0.206  1.00  0.00           C  
HETATM    3  C   UNL     1       4.042   1.985  -0.701  1.00  0.00           C  
HETATM    4  C   UNL     1       3.593   1.115  -1.847  1.00  0.00           C  
HETATM    5  C   UNL     1       3.140  -0.221  -1.317  1.00  0.00           C  
HETATM    6  C   UNL     1       4.053  -1.255  -1.184  1.00  0.00           C  
HETATM    7  C   UNL     1       3.649  -2.488  -0.698  1.00  0.00           C  
HETATM    8  O   UNL     1       4.552  -3.497  -0.572  1.00  0.00           O  
HETATM    9  C   UNL     1       5.898  -3.216  -0.959  1.00  0.00           C  
HETATM   10  C   UNL     1       2.321  -2.693  -0.340  1.00  0.00           C  
HETATM   11  O   UNL     1       1.922  -3.900   0.138  1.00  0.00           O  
HETATM   12  C   UNL     1       1.993  -4.094   1.551  1.00  0.00           C  
HETATM   13  C   UNL     1       1.397  -1.647  -0.473  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.660  -2.123   0.575  1.00  0.00           O  
HETATM   15  C   UNL     1       1.822  -0.405  -0.961  1.00  0.00           C  
HETATM   16  C   UNL     1       3.174   2.886  -0.117  1.00  0.00           C  
HETATM   17  N   UNL     1       3.599   3.636   0.889  1.00  0.00           N  
HETATM   18  C   UNL     1       4.841   3.532   1.339  1.00  0.00           C  
HETATM   19  N   UNL     1       5.247   4.333   2.392  1.00  0.00           N  
HETATM   20  N   UNL     1       5.703   2.676   0.809  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.009  -1.851  -0.097  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.896  -0.841  -0.227  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.294  -1.043   0.146  1.00  0.00           C  
HETATM   24  N   UNL     1      -3.179  -0.035   0.017  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.764   1.209  -0.482  1.00  0.00           N  
HETATM   26  C   UNL     1      -3.585   1.937  -1.176  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.585  -0.235   0.391  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.854   0.424   1.745  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.044  -0.290   2.829  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.215   0.444   4.161  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.459   0.400  -0.663  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.961   1.466  -1.412  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.769   2.074  -2.374  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.048   1.604  -2.587  1.00  0.00           C  
HETATM   35  C   UNL     1      -7.530   0.535  -1.852  1.00  0.00           C  
HETATM   36  C   UNL     1      -6.737  -0.060  -0.889  1.00  0.00           C  
HETATM   37  C   UNL     1      -4.541  -1.730   2.973  1.00  0.00           C  
HETATM   38  H   UNL     1       7.151   0.949  -0.409  1.00  0.00           H  
HETATM   39  H   UNL     1       5.980   0.438  -1.499  1.00  0.00           H  
HETATM   40  H   UNL     1       2.766   1.598  -2.368  1.00  0.00           H  
HETATM   41  H   UNL     1       4.423   0.969  -2.539  1.00  0.00           H  
HETATM   42  H   UNL     1       5.085  -1.099  -1.462  1.00  0.00           H  
HETATM   43  H   UNL     1       6.287  -2.398  -0.352  1.00  0.00           H  
HETATM   44  H   UNL     1       6.512  -4.104  -0.808  1.00  0.00           H  
HETATM   45  H   UNL     1       5.922  -2.932  -2.011  1.00  0.00           H  
HETATM   46  H   UNL     1       3.024  -3.974   1.884  1.00  0.00           H  
HETATM   47  H   UNL     1       1.362  -3.359   2.051  1.00  0.00           H  
HETATM   48  H   UNL     1       1.646  -5.098   1.798  1.00  0.00           H  
HETATM   49  H   UNL     1       1.117   0.406  -1.062  1.00  0.00           H  
HETATM   50  H   UNL     1       2.160   2.979  -0.477  1.00  0.00           H  
HETATM   51  H   UNL     1       4.624   4.961   2.791  1.00  0.00           H  
HETATM   52  H   UNL     1       6.153   4.267   2.731  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.333  -2.808   0.282  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.572   0.117  -0.607  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.260   2.885  -1.579  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.800  -1.301   0.454  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.561   1.473   1.704  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.917   0.352   1.980  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.990  -0.296   2.550  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.269   0.450   4.439  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.638  -0.064   4.933  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.861   1.470   4.058  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.394   2.909  -2.948  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.676   2.072  -3.330  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.531   0.170  -2.029  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.120  -0.894  -0.320  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.595  -1.724   3.252  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.419  -2.253   2.024  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.964  -2.238   3.745  1.00  0.00           H  
CONECT    1    2   38   39                                            
CONECT    2    1   20   20    3                                       
CONECT    3    2    4   16   16                                       
CONECT    4    3    5   40   41                                       
CONECT    5    4   15   15    6                                       
CONECT    6    5    7    7   42                                       
CONECT    7    6    6   10    8                                       
CONECT    8    7    9                                                 
CONECT    9    8   43   44   45                                       
CONECT   10   13   13    7   11                                       
CONECT   11   10   12                                                 
CONECT   12   11   46   47   48                                       
CONECT   13   15   21   10   10                                       
CONECT   14   23   23                                                 
CONECT   15    5    5   13   49                                       
CONECT   16    3    3   17   50                                       
CONECT   17   18   18   16                                            
CONECT   18   20   19   17   17                                       
CONECT   19   18   51   52                                            
CONECT   20    2    2   18                                            
CONECT   21   22   22   13   53                                       
CONECT   22   23   21   21   54                                       
CONECT   23   24   22   14   14                                       
CONECT   24   25   27   23                                            
CONECT   25   26   26   24                                            
CONECT   26   32   25   25   55                                       
CONECT   27   31   24   28   56                                       
CONECT   28   27   29   57   58                                       
CONECT   29   28   37   30   59                                       
CONECT   30   29   60   61   62                                       
CONECT   31   32   32   36   27                                       
CONECT   32   33   26   31   31                                       
CONECT   33   34   34   32   63                                       
CONECT   34   33   33   35   64                                       
CONECT   35   34   36   36   65                                       
CONECT   36   35   35   31   66                                       
CONECT   37   29   67   68   69                                       
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    6                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
CONECT   62   30                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   35                                                      
CONECT   66   36                                                      
CONECT   67   37                                                      
CONECT   68   37                                                      
CONECT   69   37                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
