COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1     -20.758   3.564 -31.519  1.00  0.00           N  
HETATM    2  C   UNL     1     -24.348   5.491 -33.378  1.00  0.00           C  
HETATM    3  N   UNL     1     -18.684  -1.817 -29.888  1.00  0.00           N  
HETATM    4  C   UNL     1     -25.199   3.149 -32.667  1.00  0.00           C  
HETATM    5  C   UNL     1     -24.927   1.645 -32.928  1.00  0.00           C  
HETATM    6  C   UNL     1     -25.907   1.050 -33.948  1.00  0.00           C  
HETATM    7  C   UNL     1     -20.540  -6.279 -30.911  1.00  0.00           C  
HETATM    8  N   UNL     1     -20.957  -5.091 -30.189  1.00  0.00           N  
HETATM    9  C   UNL     1     -20.043  -4.139 -30.038  1.00  0.00           C  
HETATM   10  O   UNL     1     -18.904  -4.268 -30.579  1.00  0.00           O  
HETATM   11  N   UNL     1     -20.464  -3.095 -29.312  1.00  0.00           N  
HETATM   12  C   UNL     1     -19.792  -1.959 -29.261  1.00  0.00           C  
HETATM   13  N   UNL     1     -20.283  -0.950 -28.539  1.00  0.00           N  
HETATM   14  C   UNL     1     -19.007   2.295 -30.342  1.00  0.00           C  
HETATM   15  C   UNL     1     -19.464   2.888 -31.691  1.00  0.00           C  
HETATM   16  C   UNL     1     -21.695   3.587 -32.455  1.00  0.00           C  
HETATM   17  O   UNL     1     -21.489   3.250 -33.590  1.00  0.00           O  
HETATM   18  O   UNL     1     -23.031   3.898 -32.050  1.00  0.00           O  
HETATM   19  C   UNL     1     -24.004   3.993 -33.095  1.00  0.00           C  
HETATM   20  C   UNL     1     -25.613   3.531 -31.242  1.00  0.00           C  
HETATM   21  C   UNL     1     -23.257   6.094 -34.269  1.00  0.00           C  
HETATM   22  C   UNL     1     -25.690   5.725 -34.043  1.00  0.00           C  
HETATM   23  O   UNL     1     -25.781   5.731 -35.237  1.00  0.00           O  
HETATM   24  O   UNL     1     -26.909   5.908 -33.270  1.00  0.00           O  
HETATM   25  C   UNL     1     -28.061   6.443 -33.931  1.00  0.00           C  
HETATM   26  C   UNL     1     -28.349   7.847 -33.383  1.00  0.00           C  
HETATM   27  C   UNL     1     -27.201   8.781 -33.727  1.00  0.00           C  
HETATM   28  C   UNL     1     -29.232   5.499 -33.691  1.00  0.00           C  
HETATM   29  O   UNL     1     -30.431   6.109 -34.143  1.00  0.00           O  
HETATM   30  C   UNL     1     -29.503   5.319 -32.193  1.00  0.00           C  
HETATM   31  C   UNL     1     -28.838   4.217 -34.511  1.00  0.00           C  
HETATM   32  C   UNL     1     -29.473   2.887 -34.084  1.00  0.00           C  
HETATM   33  C   UNL     1     -30.987   2.913 -33.918  1.00  0.00           C  
HETATM   34  O   UNL     1     -28.989   4.358 -35.933  1.00  0.00           O  
HETATM   35  C   UNL     1     -28.326   3.372 -36.738  1.00  0.00           C  
HETATM   36  C   UNL     1     -27.040   3.907 -37.352  1.00  0.00           C  
HETATM   37  C   UNL     1     -29.278   3.014 -37.878  1.00  0.00           C  
HETATM   38  O   UNL     1     -27.999   2.193 -35.975  1.00  0.00           O  
HETATM   39  C   UNL     1     -29.006   1.760 -35.031  1.00  0.00           C  
HETATM   40  C   UNL     1     -28.459   0.522 -34.263  1.00  0.00           C  
HETATM   41  C   UNL     1     -29.599  -0.186 -33.505  1.00  0.00           C  
HETATM   42  C   UNL     1     -27.282   0.831 -33.305  1.00  0.00           C  
HETATM   43  O   UNL     1     -25.978   1.913 -35.091  1.00  0.00           O  
HETATM   44  C   UNL     1     -25.334  -0.283 -34.404  1.00  0.00           C  
HETATM   45  O   UNL     1     -24.987   0.847 -31.720  1.00  0.00           O  
HETATM   46  C   UNL     1     -23.755   0.896 -31.025  1.00  0.00           C  
HETATM   47  C   UNL     1     -22.843  -0.054 -31.616  1.00  0.00           C  
HETATM   48  C   UNL     1     -22.035  -0.884 -32.125  1.00  0.00           C  
HETATM   49  C   UNL     1     -19.405   0.835 -30.111  1.00  0.00           C  
HETATM   50  C   UNL     1     -19.609   0.367 -28.626  1.00  0.00           C  
HETATM   51  H   UNL     1     -20.940   4.029 -30.653  1.00  0.00           H  
HETATM   52  H   UNL     1     -24.340   6.025 -32.417  1.00  0.00           H  
HETATM   53  H   UNL     1     -18.292  -0.907 -29.754  1.00  0.00           H  
HETATM   54  H   UNL     1     -26.036   3.431 -33.323  1.00  0.00           H  
HETATM   55  H   UNL     1     -23.916   1.563 -33.353  1.00  0.00           H  
HETATM   56  H   UNL     1     -21.380  -6.987 -30.969  1.00  0.00           H  
HETATM   57  H   UNL     1     -20.226  -5.999 -31.927  1.00  0.00           H  
HETATM   58  H   UNL     1     -19.698  -6.751 -30.384  1.00  0.00           H  
HETATM   59  H   UNL     1     -21.883  -4.994 -29.825  1.00  0.00           H  
HETATM   60  H   UNL     1     -21.314  -3.178 -28.792  1.00  0.00           H  
HETATM   61  H   UNL     1     -21.084  -1.079 -27.955  1.00  0.00           H  
HETATM   62  H   UNL     1     -17.910   2.362 -30.294  1.00  0.00           H  
HETATM   63  H   UNL     1     -19.447   2.901 -29.536  1.00  0.00           H  
HETATM   64  H   UNL     1     -19.569   2.080 -32.430  1.00  0.00           H  
HETATM   65  H   UNL     1     -18.716   3.613 -32.044  1.00  0.00           H  
HETATM   66  H   UNL     1     -23.592   3.563 -34.020  1.00  0.00           H  
HETATM   67  H   UNL     1     -26.475   2.921 -30.934  1.00  0.00           H  
HETATM   68  H   UNL     1     -24.773   3.351 -30.555  1.00  0.00           H  
HETATM   69  H   UNL     1     -25.888   4.596 -31.213  1.00  0.00           H  
HETATM   70  H   UNL     1     -22.273   5.935 -33.804  1.00  0.00           H  
HETATM   71  H   UNL     1     -23.279   5.608 -35.255  1.00  0.00           H  
HETATM   72  H   UNL     1     -23.436   7.173 -34.388  1.00  0.00           H  
HETATM   73  H   UNL     1     -27.878   6.516 -35.013  1.00  0.00           H  
HETATM   74  H   UNL     1     -29.278   8.230 -33.831  1.00  0.00           H  
HETATM   75  H   UNL     1     -28.463   7.796 -32.290  1.00  0.00           H  
HETATM   76  H   UNL     1     -27.413   9.785 -33.332  1.00  0.00           H  
HETATM   77  H   UNL     1     -26.271   8.400 -33.279  1.00  0.00           H  
HETATM   78  H   UNL     1     -27.087   8.834 -34.820  1.00  0.00           H  
HETATM   79  H   UNL     1     -30.617   6.875 -33.612  1.00  0.00           H  
HETATM   80  H   UNL     1     -29.766   6.290 -31.748  1.00  0.00           H  
HETATM   81  H   UNL     1     -30.336   4.614 -32.053  1.00  0.00           H  
HETATM   82  H   UNL     1     -28.602   4.923 -31.702  1.00  0.00           H  
HETATM   83  H   UNL     1     -27.760   4.090 -34.330  1.00  0.00           H  
HETATM   84  H   UNL     1     -29.056   2.649 -33.095  1.00  0.00           H  
HETATM   85  H   UNL     1     -31.268   3.730 -33.237  1.00  0.00           H  
HETATM   86  H   UNL     1     -31.461   3.073 -34.898  1.00  0.00           H  
HETATM   87  H   UNL     1     -31.326   1.954 -33.500  1.00  0.00           H  
HETATM   88  H   UNL     1     -26.334   4.174 -36.552  1.00  0.00           H  
HETATM   89  H   UNL     1     -26.591   3.135 -37.994  1.00  0.00           H  
HETATM   90  H   UNL     1     -27.265   4.799 -37.954  1.00  0.00           H  
HETATM   91  H   UNL     1     -30.219   2.624 -37.462  1.00  0.00           H  
HETATM   92  H   UNL     1     -29.487   3.913 -38.477  1.00  0.00           H  
HETATM   93  H   UNL     1     -28.814   2.248 -38.516  1.00  0.00           H  
HETATM   94  H   UNL     1     -29.888   1.424 -35.596  1.00  0.00           H  
HETATM   95  H   UNL     1     -28.084  -0.184 -35.018  1.00  0.00           H  
HETATM   96  H   UNL     1     -29.197  -1.058 -32.968  1.00  0.00           H  
HETATM   97  H   UNL     1     -30.049   0.513 -32.785  1.00  0.00           H  
HETATM   98  H   UNL     1     -30.365  -0.518 -34.222  1.00  0.00           H  
HETATM   99  H   UNL     1     -27.538   1.744 -32.747  1.00  0.00           H  
HETATM  100  H   UNL     1     -27.192  -0.013 -32.605  1.00  0.00           H  
HETATM  101  H   UNL     1     -26.334   2.755 -34.831  1.00  0.00           H  
HETATM  102  H   UNL     1     -25.268  -0.967 -33.545  1.00  0.00           H  
HETATM  103  H   UNL     1     -25.989  -0.720 -35.172  1.00  0.00           H  
HETATM  104  H   UNL     1     -24.330  -0.125 -34.825  1.00  0.00           H  
HETATM  105  H   UNL     1     -23.331   1.908 -31.097  1.00  0.00           H  
HETATM  106  H   UNL     1     -23.918   0.642 -29.967  1.00  0.00           H  
HETATM  107  H   UNL     1     -21.358  -1.579 -32.551  1.00  0.00           H  
HETATM  108  H   UNL     1     -20.352   0.663 -30.644  1.00  0.00           H  
HETATM  109  H   UNL     1     -18.617   0.205 -30.550  1.00  0.00           H  
HETATM  110  H   UNL     1     -18.625   0.294 -28.140  1.00  0.00           H  
HETATM  111  H   UNL     1     -20.223   1.114 -28.101  1.00  0.00           H  
CONECT    1   16   15   51                                            
CONECT    2   21   22   19   52                                       
CONECT    3   12   12   53                                            
CONECT    4   19    5   20   54                                       
CONECT    5    6    4   45   55                                       
CONECT    6   43   44   42    5                                       
CONECT    7    8   56   57   58                                       
CONECT    8    7    9   59                                            
CONECT    9   10   10    8   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12   60                                            
CONECT   12    3    3   11   13                                       
CONECT   13   12   50   61                                            
CONECT   14   15   49   62   63                                       
CONECT   15    1   14   64   65                                       
CONECT   16   17   17   18    1                                       
CONECT   17   16   16                                                 
CONECT   18   19   16                                                 
CONECT   19    2    4   18   66                                       
CONECT   20    4   67   68   69                                       
CONECT   21    2   70   71   72                                       
CONECT   22   23   23    2   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25                                                 
CONECT   25   28   26   24   73                                       
CONECT   26   25   27   74   75                                       
CONECT   27   26   76   77   78                                       
CONECT   28   31   29   25   30                                       
CONECT   29   28   79                                                 
CONECT   30   28   80   81   82                                       
CONECT   31   34   32   28   83                                       
CONECT   32   39   31   33   84                                       
CONECT   33   32   85   86   87                                       
CONECT   34   35   31                                                 
CONECT   35   37   36   38   34                                       
CONECT   36   35   88   89   90                                       
CONECT   37   35   91   92   93                                       
CONECT   38   35   39                                                 
CONECT   39   38   40   32   94                                       
CONECT   40   39   41   42   95                                       
CONECT   41   40   96   97   98                                       
CONECT   42   40    6   99  100                                       
CONECT   43    6  101                                                 
CONECT   44    6  102  103  104                                       
CONECT   45    5   46                                                 
CONECT   46   45   47  105  106                                       
CONECT   47   48   48   48   46                                       
CONECT   48   47   47   47  107                                       
CONECT   49   14   50  108  109                                       
CONECT   50   49   13  110  111                                       
CONECT   51    1                                                      
CONECT   52    2                                                      
CONECT   53    3                                                      
CONECT   54    4                                                      
CONECT   55    5                                                      
CONECT   56    7                                                      
CONECT   57    7                                                      
CONECT   58    7                                                      
CONECT   59    8                                                      
CONECT   60   11                                                      
CONECT   61   13                                                      
CONECT   62   14                                                      
CONECT   63   14                                                      
CONECT   64   15                                                      
CONECT   65   15                                                      
CONECT   66   19                                                      
CONECT   67   20                                                      
CONECT   68   20                                                      
CONECT   69   20                                                      
CONECT   70   21                                                      
CONECT   71   21                                                      
CONECT   72   21                                                      
CONECT   73   25                                                      
CONECT   74   26                                                      
CONECT   75   26                                                      
CONECT   76   27                                                      
CONECT   77   27                                                      
CONECT   78   27                                                      
CONECT   79   29                                                      
CONECT   80   30                                                      
CONECT   81   30                                                      
CONECT   82   30                                                      
CONECT   83   31                                                      
CONECT   84   32                                                      
CONECT   85   33                                                      
CONECT   86   33                                                      
CONECT   87   33                                                      
CONECT   88   36                                                      
CONECT   89   36                                                      
CONECT   90   36                                                      
CONECT   91   37                                                      
CONECT   92   37                                                      
CONECT   93   37                                                      
CONECT   94   39                                                      
CONECT   95   40                                                      
CONECT   96   41                                                      
CONECT   97   41                                                      
CONECT   98   41                                                      
CONECT   99   42                                                      
CONECT  100   42                                                      
CONECT  101   43                                                      
CONECT  102   44                                                      
CONECT  103   44                                                      
CONECT  104   44                                                      
CONECT  105   46                                                      
CONECT  106   46                                                      
CONECT  107   48                                                      
CONECT  108   49                                                      
CONECT  109   49                                                      
CONECT  110   50                                                      
CONECT  111   50                                                      
MASTER        0    0    0    0    0    0    0    0  111    0  111    0
END
