COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      92.865 100.754  42.761  1.00  0.00           N  
HETATM    2  C   UNL     1      92.758 102.134  43.036  1.00  0.00           C  
HETATM    3  O   UNL     1      90.851 100.176  43.474  1.00  0.00           O  
HETATM    4  C   UNL     1      91.949  99.795  43.027  1.00  0.00           C  
HETATM    5  C   UNL     1      92.149  98.338  42.845  1.00  0.00           C  
HETATM    6  C   UNL     1      91.018  97.376  43.182  1.00  0.00           C  
HETATM    7  C   UNL     1      93.289  97.703  42.387  1.00  0.00           C  
HETATM    8  C   UNL     1      94.621  98.173  41.962  1.00  0.00           C  
HETATM    9  C   UNL     1      94.950  99.104  41.052  1.00  0.00           C  
HETATM   10  C   UNL     1      96.396  99.488  40.736  1.00  0.00           C  
HETATM   11  C   UNL     1      97.280  99.349  42.012  1.00  0.00           C  
HETATM   12  C   UNL     1      96.429 100.958  40.284  1.00  0.00           C  
HETATM   13  O   UNL     1      95.820 101.046  38.985  1.00  0.00           O  
HETATM   14  C   UNL     1      97.823 101.681  40.356  1.00  0.00           C  
HETATM   15  C   UNL     1      98.830 101.111  39.333  1.00  0.00           C  
HETATM   16  C   UNL     1      97.715 103.242  40.242  1.00  0.00           C  
HETATM   17  O   UNL     1      97.630 103.671  38.865  1.00  0.00           O  
HETATM   18  C   UNL     1      96.576 103.908  41.032  1.00  0.00           C  
HETATM   19  C   UNL     1      96.551 103.504  42.510  1.00  0.00           C  
HETATM   20  C   UNL     1      96.548 105.456  40.911  1.00  0.00           C  
HETATM   21  O   UNL     1      97.577 106.010  41.809  1.00  0.00           O  
HETATM   22  C   UNL     1      98.825 106.348  41.409  1.00  0.00           C  
HETATM   23  O   UNL     1      99.304 106.015  40.335  1.00  0.00           O  
HETATM   24  C   UNL     1      99.654 107.169  42.346  1.00  0.00           C  
HETATM   25  C   UNL     1      95.201 106.228  41.037  1.00  0.00           C  
HETATM   26  C   UNL     1      94.155 105.807  39.976  1.00  0.00           C  
HETATM   27  C   UNL     1      95.454 107.778  41.013  1.00  0.00           C  
HETATM   28  O   UNL     1      95.409 108.343  39.692  1.00  0.00           O  
HETATM   29  C   UNL     1      96.752 108.623  39.292  1.00  0.00           C  
HETATM   30  C   UNL     1      94.533 108.481  42.019  1.00  0.00           C  
HETATM   31  C   UNL     1      94.910 108.880  43.253  1.00  0.00           C  
HETATM   32  O   UNL     1      94.068 109.511  44.213  1.00  0.00           O  
HETATM   33  C   UNL     1      92.914 108.733  44.656  1.00  0.00           C  
HETATM   34  O   UNL     1      91.814 108.633  43.721  1.00  0.00           O  
HETATM   35  C   UNL     1      91.705 107.335  43.295  1.00  0.00           C  
HETATM   36  C   UNL     1      92.310 109.230  45.991  1.00  0.00           C  
HETATM   37  C   UNL     1      93.404 107.312  44.923  1.00  0.00           C  
HETATM   38  O   UNL     1      94.281 107.040  45.724  1.00  0.00           O  
HETATM   39  C   UNL     1      92.630 106.445  43.975  1.00  0.00           C  
HETATM   40  C   UNL     1      92.652 105.037  43.677  1.00  0.00           C  
HETATM   41  C   UNL     1      91.734 104.512  42.651  1.00  0.00           C  
HETATM   42  C   UNL     1      90.822 105.427  41.982  1.00  0.00           C  
HETATM   43  O   UNL     1      89.953 104.990  41.023  1.00  0.00           O  
HETATM   44  C   UNL     1      90.820 106.816  42.311  1.00  0.00           C  
HETATM   45  C   UNL     1      89.872 107.778  41.618  1.00  0.00           C  
HETATM   46  C   UNL     1      91.782 103.027  42.334  1.00  0.00           C  
HETATM   47  O   UNL     1      91.028 102.536  41.487  1.00  0.00           O  
HETATM   48  C   UNL     1      93.613 104.095  44.335  1.00  0.00           C  
HETATM   49  N   UNL     1      94.527 104.336  45.226  1.00  0.00           N  
HETATM   50  C   UNL     1      95.262 103.153  45.575  1.00  0.00           C  
HETATM   51  N   UNL     1      94.669 102.061  44.766  1.00  0.00           N  
HETATM   52  C   UNL     1      93.653 102.641  43.996  1.00  0.00           C  
HETATM   53  C   UNL     1      96.316 102.934  46.460  1.00  0.00           C  
HETATM   54  C   UNL     1      96.836 101.639  46.573  1.00  0.00           C  
HETATM   55  C   UNL     1      95.229 100.833  44.938  1.00  0.00           C  
HETATM   56  C   UNL     1      96.294 100.590  45.811  1.00  0.00           C  
HETATM   57  C   UNL     1      97.984 101.358  47.519  1.00  0.00           C  
HETATM   58  H   UNL     1      93.711 100.452  42.321  1.00  0.00           H  
HETATM   59  H   UNL     1      90.146  97.945  43.538  1.00  0.00           H  
HETATM   60  H   UNL     1      90.741  96.806  42.283  1.00  0.00           H  
HETATM   61  H   UNL     1      91.349  96.682  43.968  1.00  0.00           H  
HETATM   62  H   UNL     1      93.180  96.630  42.328  1.00  0.00           H  
HETATM   63  H   UNL     1      95.455  97.698  42.456  1.00  0.00           H  
HETATM   64  H   UNL     1      94.156  99.605  40.518  1.00  0.00           H  
HETATM   65  H   UNL     1      96.792  98.842  39.939  1.00  0.00           H  
HETATM   66  H   UNL     1      97.271  98.303  42.353  1.00  0.00           H  
HETATM   67  H   UNL     1      98.312  99.649  41.777  1.00  0.00           H  
HETATM   68  H   UNL     1      96.882  99.997  42.806  1.00  0.00           H  
HETATM   69  H   UNL     1      95.778 101.503  40.983  1.00  0.00           H  
HETATM   70  H   UNL     1      94.984 100.595  38.996  1.00  0.00           H  
HETATM   71  H   UNL     1      98.232 101.469  41.355  1.00  0.00           H  
HETATM   72  H   UNL     1      98.882 100.017  39.439  1.00  0.00           H  
HETATM   73  H   UNL     1      98.501 101.365  38.314  1.00  0.00           H  
HETATM   74  H   UNL     1      99.824 101.545  39.517  1.00  0.00           H  
HETATM   75  H   UNL     1      98.653 103.642  40.654  1.00  0.00           H  
HETATM   76  H   UNL     1      97.566 104.618  38.831  1.00  0.00           H  
HETATM   77  H   UNL     1      95.636 103.546  40.591  1.00  0.00           H  
HETATM   78  H   UNL     1      95.717 104.013  43.016  1.00  0.00           H  
HETATM   79  H   UNL     1      96.419 102.415  42.590  1.00  0.00           H  
HETATM   80  H   UNL     1      97.500 103.794  42.985  1.00  0.00           H  
HETATM   81  H   UNL     1      96.899 105.666  39.890  1.00  0.00           H  
HETATM   82  H   UNL     1     100.638 107.361  41.893  1.00  0.00           H  
HETATM   83  H   UNL     1      99.147 108.126  42.542  1.00  0.00           H  
HETATM   84  H   UNL     1      99.786 106.624  43.292  1.00  0.00           H  
HETATM   85  H   UNL     1      94.780 105.986  42.024  1.00  0.00           H  
HETATM   86  H   UNL     1      93.232 106.387  40.120  1.00  0.00           H  
HETATM   87  H   UNL     1      94.555 106.000  38.970  1.00  0.00           H  
HETATM   88  H   UNL     1      93.935 104.735  40.084  1.00  0.00           H  
HETATM   89  H   UNL     1      96.478 107.917  41.390  1.00  0.00           H  
HETATM   90  H   UNL     1      96.751 109.058  38.282  1.00  0.00           H  
HETATM   91  H   UNL     1      97.203 109.336  39.998  1.00  0.00           H  
HETATM   92  H   UNL     1      97.336 107.691  39.289  1.00  0.00           H  
HETATM   93  H   UNL     1      93.513 108.670  41.720  1.00  0.00           H  
HETATM   94  H   UNL     1      95.938 108.706  43.536  1.00  0.00           H  
HETATM   95  H   UNL     1      93.108 109.324  46.742  1.00  0.00           H  
HETATM   96  H   UNL     1      91.835 110.210  45.836  1.00  0.00           H  
HETATM   97  H   UNL     1      91.558 108.509  46.344  1.00  0.00           H  
HETATM   98  H   UNL     1      90.058 104.053  40.903  1.00  0.00           H  
HETATM   99  H   UNL     1      88.930 107.836  42.183  1.00  0.00           H  
HETATM  100  H   UNL     1      90.333 108.776  41.570  1.00  0.00           H  
HETATM  101  H   UNL     1      89.666 107.419  40.599  1.00  0.00           H  
HETATM  102  H   UNL     1      96.723 103.745  47.046  1.00  0.00           H  
HETATM  103  H   UNL     1      94.831 100.004  44.372  1.00  0.00           H  
HETATM  104  H   UNL     1      96.701  99.594  45.900  1.00  0.00           H  
HETATM  105  H   UNL     1      98.938 101.494  46.989  1.00  0.00           H  
HETATM  106  H   UNL     1      97.936 102.053  48.371  1.00  0.00           H  
HETATM  107  H   UNL     1      97.912 100.323  47.885  1.00  0.00           H  
HETATM  108  H   UNL     1      91.193 101.603  41.418  1.00  0.00           H  
CONECT    1    4    2   58                                            
CONECT    2   46    1   52   52                                       
CONECT    3    4    4                                                 
CONECT    4    1    5    3    3                                       
CONECT    5    7    7    4    6                                       
CONECT    6    5   59   60   61                                       
CONECT    7    8    5    5   62                                       
CONECT    8    9    9    7   63                                       
CONECT    9   10    8    8   64                                       
CONECT   10   12    9   11   65                                       
CONECT   11   10   66   67   68                                       
CONECT   12   13   14   10   69                                       
CONECT   13   12   70                                                 
CONECT   14   15   16   12   71                                       
CONECT   15   14   72   73   74                                       
CONECT   16   17   14   18   75                                       
CONECT   17   16   76                                                 
CONECT   18   16   20   19   77                                       
CONECT   19   18   78   79   80                                       
CONECT   20   18   25   21   81                                       
CONECT   21   20   22                                                 
CONECT   22   23   23   21   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   82   83   84                                       
CONECT   25   26   20   27   85                                       
CONECT   26   25   86   87   88                                       
CONECT   27   28   25   30   89                                       
CONECT   28   29   27                                                 
CONECT   29   28   90   91   92                                       
CONECT   30   27   31   31   93                                       
CONECT   31   30   30   32   94                                       
CONECT   32   31   33                                                 
CONECT   33   34   32   37   36                                       
CONECT   34   35   33                                                 
CONECT   35   44   34   39   39                                       
CONECT   36   33   95   96   97                                       
CONECT   37   39   33   38   38                                       
CONECT   38   37   37                                                 
CONECT   39   35   35   40   37                                       
CONECT   40   41   39   48   48                                       
CONECT   41   42   46   46   40                                       
CONECT   42   43   44   44   41                                       
CONECT   43   42   98                                                 
CONECT   44   45   42   42   35                                       
CONECT   45   44   99  100  101                                       
CONECT   46   47   41   41    2                                       
CONECT   47   46  108                                                 
CONECT   48   40   40   52   49                                       
CONECT   49   48   50   50                                            
CONECT   50   51   49   49   53                                       
CONECT   51   52   55   50                                            
CONECT   52    2    2   48   51                                       
CONECT   53   50   54   54  102                                       
CONECT   54   56   53   53   57                                       
CONECT   55   51   56   56  103                                       
CONECT   56   55   55   54  104                                       
CONECT   57   54  105  106  107                                       
CONECT   58    1                                                      
CONECT   59    6                                                      
CONECT   60    6                                                      
CONECT   61    6                                                      
CONECT   62    7                                                      
CONECT   63    8                                                      
CONECT   64    9                                                      
CONECT   65   10                                                      
CONECT   66   11                                                      
CONECT   67   11                                                      
CONECT   68   11                                                      
CONECT   69   12                                                      
CONECT   70   13                                                      
CONECT   71   14                                                      
CONECT   72   15                                                      
CONECT   73   15                                                      
CONECT   74   15                                                      
CONECT   75   16                                                      
CONECT   76   17                                                      
CONECT   77   18                                                      
CONECT   78   19                                                      
CONECT   79   19                                                      
CONECT   80   19                                                      
CONECT   81   20                                                      
CONECT   82   24                                                      
CONECT   83   24                                                      
CONECT   84   24                                                      
CONECT   85   25                                                      
CONECT   86   26                                                      
CONECT   87   26                                                      
CONECT   88   26                                                      
CONECT   89   27                                                      
CONECT   90   29                                                      
CONECT   91   29                                                      
CONECT   92   29                                                      
CONECT   93   30                                                      
CONECT   94   31                                                      
CONECT   95   36                                                      
CONECT   96   36                                                      
CONECT   97   36                                                      
CONECT   98   43                                                      
CONECT   99   45                                                      
CONECT  100   45                                                      
CONECT  101   45                                                      
CONECT  102   53                                                      
CONECT  103   55                                                      
CONECT  104   56                                                      
CONECT  105   57                                                      
CONECT  106   57                                                      
CONECT  107   57                                                      
CONECT  108   47                                                      
MASTER        0    0    0    0    0    0    0    0  108    0  108    0
END
