COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.352  -1.065   0.259  1.00  0.00           C  
HETATM    2  O   UNL     1      -3.140  -1.800   1.200  1.00  0.00           O  
HETATM    3  C   UNL     1      -4.764  -0.841  -0.219  1.00  0.00           C  
HETATM    4  O   UNL     1      -5.666  -1.599   0.591  1.00  0.00           O  
HETATM    5  C   UNL     1      -6.989  -1.508   0.291  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.920  -2.217   1.036  1.00  0.00           C  
HETATM    7  C   UNL     1      -9.264  -2.124   0.729  1.00  0.00           C  
HETATM    8  C   UNL     1      -9.681  -1.325  -0.320  1.00  0.00           C  
HETATM    9  C   UNL     1      -8.754  -0.618  -1.064  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.410  -0.703  -0.757  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.327  -0.443  -0.356  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.954  -0.660   0.108  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.103   0.525  -0.269  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.471   1.283  -1.141  1.00  0.00           O  
HETATM   15  C   UNL     1      -0.389  -1.923  -0.545  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.192  -3.140  -0.082  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.485  -1.797  -2.067  1.00  0.00           C  
HETATM   18  C   UNL     1       7.471  -1.891   1.165  1.00  0.00           C  
HETATM   19  C   UNL     1       8.805  -2.100   1.459  1.00  0.00           C  
HETATM   20  C   UNL     1       9.754  -2.023   0.457  1.00  0.00           C  
HETATM   21  C   UNL     1       9.369  -1.737  -0.839  1.00  0.00           C  
HETATM   22  C   UNL     1       8.034  -1.529  -1.134  1.00  0.00           C  
HETATM   23  C   UNL     1       7.085  -1.606  -0.132  1.00  0.00           C  
HETATM   24  C   UNL     1       5.630  -1.385  -0.454  1.00  0.00           C  
HETATM   25  C   UNL     1       5.293   0.100  -0.299  1.00  0.00           C  
HETATM   26  O   UNL     1       4.827   0.801  -1.454  1.00  0.00           O  
HETATM   27  C   UNL     1       3.832   0.521  -0.468  1.00  0.00           C  
HETATM   28  C   UNL     1       3.323   1.686   0.382  1.00  0.00           C  
HETATM   29  O   UNL     1       3.461   1.362   1.767  1.00  0.00           O  
HETATM   30  C   UNL     1       1.849   1.945   0.064  1.00  0.00           C  
HETATM   31  C   UNL     1       1.340   3.110   0.914  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.073   3.445   0.514  1.00  0.00           C  
HETATM   33  C   UNL     1      -0.308   4.368  -0.488  1.00  0.00           C  
HETATM   34  C   UNL     1      -1.605   4.675  -0.855  1.00  0.00           C  
HETATM   35  C   UNL     1      -2.667   4.058  -0.221  1.00  0.00           C  
HETATM   36  C   UNL     1      -2.433   3.134   0.780  1.00  0.00           C  
HETATM   37  C   UNL     1      -1.136   2.824   1.144  1.00  0.00           C  
HETATM   38  N   UNL     1       1.067   0.743   0.364  1.00  0.00           N  
HETATM   39  H   UNL     1      -5.010   0.218  -0.143  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.852  -1.161  -1.257  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.595  -2.841   1.855  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.989  -2.675   1.308  1.00  0.00           H  
HETATM   43  H   UNL     1     -10.731  -1.253  -0.558  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.083   0.009  -1.880  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.687  -0.151  -1.339  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.497   0.148  -1.106  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.952  -0.779   1.192  1.00  0.00           H  
HETATM   48  H   UNL     1       0.655  -2.045  -0.256  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.211  -3.069  -0.463  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.724  -4.049  -0.461  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.212  -3.169   1.008  1.00  0.00           H  
HETATM   52  H   UNL     1       0.087  -0.929  -2.396  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.082  -2.696  -2.532  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.529  -1.675  -2.355  1.00  0.00           H  
HETATM   55  H   UNL     1       6.729  -1.956   1.947  1.00  0.00           H  
HETATM   56  H   UNL     1       9.106  -2.323   2.472  1.00  0.00           H  
HETATM   57  H   UNL     1      10.797  -2.185   0.687  1.00  0.00           H  
HETATM   58  H   UNL     1      10.111  -1.677  -1.622  1.00  0.00           H  
HETATM   59  H   UNL     1       7.733  -1.307  -2.147  1.00  0.00           H  
HETATM   60  H   UNL     1       5.433  -1.697  -1.480  1.00  0.00           H  
HETATM   61  H   UNL     1       5.014  -1.970   0.228  1.00  0.00           H  
HETATM   62  H   UNL     1       5.901   0.650   0.419  1.00  0.00           H  
HETATM   63  H   UNL     1       3.102  -0.257  -0.690  1.00  0.00           H  
HETATM   64  H   UNL     1       3.905   2.580   0.159  1.00  0.00           H  
HETATM   65  H   UNL     1       2.969   0.575   2.038  1.00  0.00           H  
HETATM   66  H   UNL     1       1.744   2.192  -0.992  1.00  0.00           H  
HETATM   67  H   UNL     1       1.363   2.829   1.967  1.00  0.00           H  
HETATM   68  H   UNL     1       1.978   3.980   0.757  1.00  0.00           H  
HETATM   69  H   UNL     1       0.522   4.850  -0.983  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.788   5.397  -1.637  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.680   4.299  -0.507  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.263   2.653   1.276  1.00  0.00           H  
HETATM   73  H   UNL     1      -0.952   2.099   1.923  1.00  0.00           H  
HETATM   74  H   UNL     1       1.391   0.104   1.018  1.00  0.00           H  
CONECT    1   11    3    2    2                                       
CONECT    2    1    1                                                 
CONECT    3    4    1   39   40                                       
CONECT    4    5    3                                                 
CONECT    5   10    4    6    6                                       
CONECT    6    5    5    7   41                                       
CONECT    7    8    8    6   42                                       
CONECT    8    9    7    7   43                                       
CONECT    9   10   10    8   44                                       
CONECT   10    9    9    5   45                                       
CONECT   11   12    1   46                                            
CONECT   12   13   15   11   47                                       
CONECT   13   14   14   38   12                                       
CONECT   14   13   13                                                 
CONECT   15   17   12   16   48                                       
CONECT   16   15   49   50   51                                       
CONECT   17   15   52   53   54                                       
CONECT   18   19   19   23   55                                       
CONECT   19   20   18   18   56                                       
CONECT   20   21   21   19   57                                       
CONECT   21   20   20   22   58                                       
CONECT   22   21   23   23   59                                       
CONECT   23   22   22   18   24                                       
CONECT   24   23   25   60   61                                       
CONECT   25   26   24   27   62                                       
CONECT   26   25   27                                                 
CONECT   27   26   25   28   63                                       
CONECT   28   27   30   29   64                                       
CONECT   29   28   65                                                 
CONECT   30   28   38   31   66                                       
CONECT   31   30   32   67   68                                       
CONECT   32   33   31   37   37                                       
CONECT   33   34   34   32   69                                       
CONECT   34   33   33   35   70                                       
CONECT   35   34   36   36   71                                       
CONECT   36   35   35   37   72                                       
CONECT   37   32   32   36   73                                       
CONECT   38   13   30   74                                            
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   24                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   29                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   33                                                      
CONECT   70   34                                                      
CONECT   71   35                                                      
CONECT   72   36                                                      
CONECT   73   37                                                      
CONECT   74   38                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
