COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      17.108  -1.197   0.921  1.00  0.00           C  
HETATM    2  C   UNL     1      15.910  -0.249   1.019  1.00  0.00           C  
HETATM    3  C   UNL     1      14.637  -0.992   0.608  1.00  0.00           C  
HETATM    4  C   UNL     1      13.440  -0.044   0.706  1.00  0.00           C  
HETATM    5  C   UNL     1      12.167  -0.786   0.295  1.00  0.00           C  
HETATM    6  C   UNL     1      10.970   0.161   0.394  1.00  0.00           C  
HETATM    7  C   UNL     1       9.696  -0.581  -0.017  1.00  0.00           C  
HETATM    8  C   UNL     1       8.499   0.366   0.081  1.00  0.00           C  
HETATM    9  C   UNL     1       7.226  -0.376  -0.330  1.00  0.00           C  
HETATM   10  N   UNL     1       6.080   0.531  -0.236  1.00  0.00           N  
HETATM   11  C   UNL     1       4.845   0.093  -0.552  1.00  0.00           C  
HETATM   12  O   UNL     1       4.683  -1.054  -0.914  1.00  0.00           O  
HETATM   13  C   UNL     1       3.666   1.026  -0.455  1.00  0.00           C  
HETATM   14  C   UNL     1       2.393   0.283  -0.866  1.00  0.00           C  
HETATM   15  C   UNL     1       1.196   1.231  -0.768  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.077   0.489  -1.179  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.344  -0.555  -0.240  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.253   1.467  -1.201  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.987   2.511  -2.139  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.527   0.725  -1.612  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.673   1.726  -1.767  1.00  0.00           C  
HETATM   22  O   UNL     1      -3.827   2.466  -0.554  1.00  0.00           O  
HETATM   23  C   UNL     1      -4.878   3.434  -0.594  1.00  0.00           C  
HETATM   24  O   UNL     1      -6.141   2.766  -0.613  1.00  0.00           O  
HETATM   25  C   UNL     1      -6.367   1.913   0.512  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.730   1.233   0.370  1.00  0.00           C  
HETATM   27  O   UNL     1      -7.714   0.365  -0.765  1.00  0.00           O  
HETATM   28  C   UNL     1      -6.343   2.747   1.796  1.00  0.00           C  
HETATM   29  O   UNL     1      -7.401   3.706   1.762  1.00  0.00           O  
HETATM   30  C   UNL     1      -4.998   3.472   1.899  1.00  0.00           C  
HETATM   31  O   UNL     1      -4.994   4.310   3.057  1.00  0.00           O  
HETATM   32  C   UNL     1      -4.794   4.328   0.646  1.00  0.00           C  
HETATM   33  O   UNL     1      -3.510   4.953   0.698  1.00  0.00           O  
HETATM   34  N   UNL     1      -2.873  -0.258  -0.582  1.00  0.00           N  
HETATM   35  C   UNL     1      -3.605  -1.343  -0.904  1.00  0.00           C  
HETATM   36  O   UNL     1      -3.977  -1.506  -2.047  1.00  0.00           O  
HETATM   37  C   UNL     1      -3.961  -2.354   0.155  1.00  0.00           C  
HETATM   38  C   UNL     1      -4.789  -3.478  -0.470  1.00  0.00           C  
HETATM   39  C   UNL     1      -5.150  -4.504   0.605  1.00  0.00           C  
HETATM   40  C   UNL     1      -5.978  -5.629  -0.020  1.00  0.00           C  
HETATM   41  C   UNL     1      -6.340  -6.655   1.056  1.00  0.00           C  
HETATM   42  C   UNL     1      -7.168  -7.779   0.430  1.00  0.00           C  
HETATM   43  C   UNL     1      -7.529  -8.806   1.506  1.00  0.00           C  
HETATM   44  H   UNL     1      18.014  -0.668   1.214  1.00  0.00           H  
HETATM   45  H   UNL     1      16.953  -2.048   1.584  1.00  0.00           H  
HETATM   46  H   UNL     1      17.208  -1.550  -0.105  1.00  0.00           H  
HETATM   47  H   UNL     1      15.810   0.104   2.045  1.00  0.00           H  
HETATM   48  H   UNL     1      16.065   0.601   0.355  1.00  0.00           H  
HETATM   49  H   UNL     1      14.738  -1.345  -0.418  1.00  0.00           H  
HETATM   50  H   UNL     1      14.482  -1.842   1.272  1.00  0.00           H  
HETATM   51  H   UNL     1      13.339   0.309   1.732  1.00  0.00           H  
HETATM   52  H   UNL     1      13.595   0.807   0.043  1.00  0.00           H  
HETATM   53  H   UNL     1      12.267  -1.140  -0.731  1.00  0.00           H  
HETATM   54  H   UNL     1      12.012  -1.637   0.959  1.00  0.00           H  
HETATM   55  H   UNL     1      10.869   0.515   1.420  1.00  0.00           H  
HETATM   56  H   UNL     1      11.124   1.012  -0.270  1.00  0.00           H  
HETATM   57  H   UNL     1       9.797  -0.935  -1.043  1.00  0.00           H  
HETATM   58  H   UNL     1       9.542  -1.432   0.646  1.00  0.00           H  
HETATM   59  H   UNL     1       8.399   0.720   1.107  1.00  0.00           H  
HETATM   60  H   UNL     1       8.654   1.217  -0.583  1.00  0.00           H  
HETATM   61  H   UNL     1       7.327  -0.729  -1.356  1.00  0.00           H  
HETATM   62  H   UNL     1       7.071  -1.227   0.334  1.00  0.00           H  
HETATM   63  H   UNL     1       6.209   1.448   0.053  1.00  0.00           H  
HETATM   64  H   UNL     1       3.566   1.379   0.571  1.00  0.00           H  
HETATM   65  H   UNL     1       3.821   1.877  -1.119  1.00  0.00           H  
HETATM   66  H   UNL     1       2.493  -0.070  -1.892  1.00  0.00           H  
HETATM   67  H   UNL     1       2.238  -0.567  -0.202  1.00  0.00           H  
HETATM   68  H   UNL     1       1.095   1.584   0.258  1.00  0.00           H  
HETATM   69  H   UNL     1       1.350   2.082  -1.431  1.00  0.00           H  
HETATM   70  H   UNL     1       0.057   0.059  -2.171  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.474  -0.245   0.667  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.388   1.896  -0.208  1.00  0.00           H  
HETATM   73  H   UNL     1      -0.830   2.199  -3.041  1.00  0.00           H  
HETATM   74  H   UNL     1      -2.359   0.213  -2.560  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.449   2.411  -2.585  1.00  0.00           H  
HETATM   76  H   UNL     1      -4.597   1.189  -1.985  1.00  0.00           H  
HETATM   77  H   UNL     1      -4.776   4.044  -1.490  1.00  0.00           H  
HETATM   78  H   UNL     1      -5.585   1.155   0.556  1.00  0.00           H  
HETATM   79  H   UNL     1      -7.942   0.653   1.269  1.00  0.00           H  
HETATM   80  H   UNL     1      -8.502   1.991   0.237  1.00  0.00           H  
HETATM   81  H   UNL     1      -8.548  -0.101  -0.916  1.00  0.00           H  
HETATM   82  H   UNL     1      -6.472   2.092   2.658  1.00  0.00           H  
HETATM   83  H   UNL     1      -7.446   4.271   2.546  1.00  0.00           H  
HETATM   84  H   UNL     1      -4.194   2.740   1.977  1.00  0.00           H  
HETATM   85  H   UNL     1      -4.171   4.800   3.185  1.00  0.00           H  
HETATM   86  H   UNL     1      -5.570   5.092   0.597  1.00  0.00           H  
HETATM   87  H   UNL     1      -3.311   5.508  -0.068  1.00  0.00           H  
HETATM   88  H   UNL     1      -2.575  -0.128   0.332  1.00  0.00           H  
HETATM   89  H   UNL     1      -3.048  -2.769   0.582  1.00  0.00           H  
HETATM   90  H   UNL     1      -4.541  -1.869   0.940  1.00  0.00           H  
HETATM   91  H   UNL     1      -5.701  -3.063  -0.897  1.00  0.00           H  
HETATM   92  H   UNL     1      -4.208  -3.963  -1.255  1.00  0.00           H  
HETATM   93  H   UNL     1      -4.238  -4.920   1.033  1.00  0.00           H  
HETATM   94  H   UNL     1      -5.730  -4.019   1.390  1.00  0.00           H  
HETATM   95  H   UNL     1      -6.891  -5.213  -0.447  1.00  0.00           H  
HETATM   96  H   UNL     1      -5.398  -6.114  -0.805  1.00  0.00           H  
HETATM   97  H   UNL     1      -5.427  -7.070   1.483  1.00  0.00           H  
HETATM   98  H   UNL     1      -6.920  -6.170   1.840  1.00  0.00           H  
HETATM   99  H   UNL     1      -8.081  -7.364   0.003  1.00  0.00           H  
HETATM  100  H   UNL     1      -6.588  -8.264  -0.355  1.00  0.00           H  
HETATM  101  H   UNL     1      -6.617  -9.221   1.933  1.00  0.00           H  
HETATM  102  H   UNL     1      -8.110  -8.320   2.291  1.00  0.00           H  
HETATM  103  H   UNL     1      -8.119  -9.606   1.060  1.00  0.00           H  
CONECT    1    2   44   45   46                                       
CONECT    2    1    3   47   48                                       
CONECT    3    2    4   49   50                                       
CONECT    4    3    5   51   52                                       
CONECT    5    4    6   53   54                                       
CONECT    6    5    7   55   56                                       
CONECT    7    6    8   57   58                                       
CONECT    8    7    9   59   60                                       
CONECT    9    8   10   61   62                                       
CONECT   10    9   11   63                                            
CONECT   11   10   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   64   65                                       
CONECT   14   13   15   66   67                                       
CONECT   15   14   16   68   69                                       
CONECT   16   15   17   18   70                                       
CONECT   17   16   71                                                 
CONECT   18   16   19   20   72                                       
CONECT   19   18   73                                                 
CONECT   20   18   34   21   74                                       
CONECT   21   20   22   75   76                                       
CONECT   22   21   23                                                 
CONECT   23   22   32   24   77                                       
CONECT   24   23   25                                                 
CONECT   25   24   28   26   78                                       
CONECT   26   25   27   79   80                                       
CONECT   27   26   81                                                 
CONECT   28   30   25   29   82                                       
CONECT   29   28   83                                                 
CONECT   30   32   28   31   84                                       
CONECT   31   30   85                                                 
CONECT   32   33   23   30   86                                       
CONECT   33   32   87                                                 
CONECT   34   20   35   88                                            
CONECT   35   36   36   34   37                                       
CONECT   36   35   35                                                 
CONECT   37   35   38   89   90                                       
CONECT   38   39   37   91   92                                       
CONECT   39   40   38   93   94                                       
CONECT   40   41   39   95   96                                       
CONECT   41   42   40   97   98                                       
CONECT   42   43   41   99  100                                       
CONECT   43   42  101  102  103                                       
CONECT   44    1                                                      
CONECT   45    1                                                      
CONECT   46    1                                                      
CONECT   47    2                                                      
CONECT   48    2                                                      
CONECT   49    3                                                      
CONECT   50    3                                                      
CONECT   51    4                                                      
CONECT   52    4                                                      
CONECT   53    5                                                      
CONECT   54    5                                                      
CONECT   55    6                                                      
CONECT   56    6                                                      
CONECT   57    7                                                      
CONECT   58    7                                                      
CONECT   59    8                                                      
CONECT   60    8                                                      
CONECT   61    9                                                      
CONECT   62    9                                                      
CONECT   63   10                                                      
CONECT   64   13                                                      
CONECT   65   13                                                      
CONECT   66   14                                                      
CONECT   67   14                                                      
CONECT   68   15                                                      
CONECT   69   15                                                      
CONECT   70   16                                                      
CONECT   71   17                                                      
CONECT   72   18                                                      
CONECT   73   19                                                      
CONECT   74   20                                                      
CONECT   75   21                                                      
CONECT   76   21                                                      
CONECT   77   23                                                      
CONECT   78   25                                                      
CONECT   79   26                                                      
CONECT   80   26                                                      
CONECT   81   27                                                      
CONECT   82   28                                                      
CONECT   83   29                                                      
CONECT   84   30                                                      
CONECT   85   31                                                      
CONECT   86   32                                                      
CONECT   87   33                                                      
CONECT   88   34                                                      
CONECT   89   37                                                      
CONECT   90   37                                                      
CONECT   91   38                                                      
CONECT   92   38                                                      
CONECT   93   39                                                      
CONECT   94   39                                                      
CONECT   95   40                                                      
CONECT   96   40                                                      
CONECT   97   41                                                      
CONECT   98   41                                                      
CONECT   99   42                                                      
CONECT  100   42                                                      
CONECT  101   43                                                      
CONECT  102   43                                                      
CONECT  103   43                                                      
MASTER        0    0    0    0    0    0    0    0  103    0  103    0
END
