COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -7.078  -3.672   0.873  1.00  0.00           O  
HETATM    2  C   UNL     1      -7.719  -2.894   1.552  1.00  0.00           C  
HETATM    3  O   UNL     1      -8.177  -3.274   2.762  1.00  0.00           O  
HETATM    4  C   UNL     1      -7.990  -1.538   1.057  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.464  -1.133  -0.097  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.726  -2.112  -0.973  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.607   0.305  -0.526  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.363   1.089  -0.104  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.280   1.129   1.424  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.451   2.516  -0.647  1.00  0.00           C  
HETATM   11  O   UNL     1      -7.552   3.192  -0.037  1.00  0.00           O  
HETATM   12  C   UNL     1      -5.155   3.264  -0.329  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.290   4.726  -0.759  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.011   2.626  -1.074  1.00  0.00           C  
HETATM   15  O   UNL     1      -4.208   2.085  -2.136  1.00  0.00           O  
HETATM   16  C   UNL     1      -2.620   2.662  -0.495  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.942   3.980  -0.878  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.818   1.508  -1.038  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.396   0.549  -0.221  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.802   0.563   1.230  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.531  -0.525  -0.733  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.109  -1.484   0.084  1.00  0.00           C  
HETATM   23  C   UNL     1       0.777  -2.585  -0.441  1.00  0.00           C  
HETATM   24  C   UNL     1       2.055  -2.654   0.397  1.00  0.00           C  
HETATM   25  C   UNL     1       1.705  -3.064   1.829  1.00  0.00           C  
HETATM   26  C   UNL     1       2.993  -3.670  -0.201  1.00  0.00           C  
HETATM   27  C   UNL     1       4.234  -3.321  -0.522  1.00  0.00           C  
HETATM   28  C   UNL     1       5.207  -4.362  -1.012  1.00  0.00           C  
HETATM   29  C   UNL     1       5.207  -4.381  -2.542  1.00  0.00           C  
HETATM   30  C   UNL     1       4.658  -1.918  -0.399  1.00  0.00           C  
HETATM   31  C   UNL     1       5.865  -1.549  -0.816  1.00  0.00           C  
HETATM   32  C   UNL     1       6.300  -0.112  -0.690  1.00  0.00           C  
HETATM   33  O   UNL     1       6.597   0.411  -1.986  1.00  0.00           O  
HETATM   34  C   UNL     1       7.548  -0.031   0.191  1.00  0.00           C  
HETATM   35  C   UNL     1       8.709  -0.746  -0.503  1.00  0.00           C  
HETATM   36  C   UNL     1       7.916   1.436   0.422  1.00  0.00           C  
HETATM   37  C   UNL     1       9.087   1.520   1.402  1.00  0.00           C  
HETATM   38  C   UNL     1       9.450   2.965   1.629  1.00  0.00           C  
HETATM   39  O   UNL     1      10.456   3.282   2.459  1.00  0.00           O  
HETATM   40  O   UNL     1       8.835   3.838   1.064  1.00  0.00           O  
HETATM   41  H   UNL     1      -7.970  -4.175   3.046  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.617  -0.869   1.629  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.691  -2.187  -0.641  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.202  -3.090  -0.905  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.752  -1.765  -2.006  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.714   0.351  -1.610  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.488   0.739  -0.055  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.473   0.602  -0.503  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.303   0.113   1.816  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.352   1.615   1.725  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.128   1.690   1.819  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.597   2.485  -1.727  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.489   3.257   0.926  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.962   3.217   0.742  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.570   4.771  -1.812  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.059   5.212  -0.158  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.339   5.238  -0.614  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.677   2.586   0.591  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.522   4.814  -0.485  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.937   4.006  -0.459  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.885   4.056  -1.964  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.587   1.460  -2.092  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.693  -0.051   1.363  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.991   0.162   1.838  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.016   1.586   1.538  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.240  -0.535  -1.773  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.400  -1.474   1.124  1.00  0.00           H  
HETATM   68  H   UNL     1       0.249  -3.537  -0.377  1.00  0.00           H  
HETATM   69  H   UNL     1       1.034  -2.381  -1.480  1.00  0.00           H  
HETATM   70  H   UNL     1       2.536  -1.676   0.406  1.00  0.00           H  
HETATM   71  H   UNL     1       1.223  -4.042   1.820  1.00  0.00           H  
HETATM   72  H   UNL     1       2.616  -3.113   2.426  1.00  0.00           H  
HETATM   73  H   UNL     1       1.026  -2.329   2.262  1.00  0.00           H  
HETATM   74  H   UNL     1       2.657  -4.683  -0.369  1.00  0.00           H  
HETATM   75  H   UNL     1       6.208  -4.122  -0.652  1.00  0.00           H  
HETATM   76  H   UNL     1       4.911  -5.341  -0.636  1.00  0.00           H  
HETATM   77  H   UNL     1       5.911  -5.134  -2.896  1.00  0.00           H  
HETATM   78  H   UNL     1       4.206  -4.621  -2.902  1.00  0.00           H  
HETATM   79  H   UNL     1       5.503  -3.401  -2.918  1.00  0.00           H  
HETATM   80  H   UNL     1       3.989  -1.187   0.030  1.00  0.00           H  
HETATM   81  H   UNL     1       6.535  -2.280  -1.244  1.00  0.00           H  
HETATM   82  H   UNL     1       5.497   0.472  -0.238  1.00  0.00           H  
HETATM   83  H   UNL     1       7.304  -0.061  -2.448  1.00  0.00           H  
HETATM   84  H   UNL     1       7.347  -0.510   1.150  1.00  0.00           H  
HETATM   85  H   UNL     1       8.447  -1.791  -0.667  1.00  0.00           H  
HETATM   86  H   UNL     1       8.910  -0.267  -1.461  1.00  0.00           H  
HETATM   87  H   UNL     1       9.598  -0.689   0.125  1.00  0.00           H  
HETATM   88  H   UNL     1       8.202   1.891  -0.526  1.00  0.00           H  
HETATM   89  H   UNL     1       7.057   1.965   0.835  1.00  0.00           H  
HETATM   90  H   UNL     1       8.801   1.064   2.350  1.00  0.00           H  
HETATM   91  H   UNL     1       9.946   0.990   0.989  1.00  0.00           H  
HETATM   92  H   UNL     1      10.652   4.222   2.572  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    4    3                                       
CONECT    3    2   41                                                 
CONECT    4    5    5    2   42                                       
CONECT    5    6    7    4    4                                       
CONECT    6    5   43   44   45                                       
CONECT    7    8    5   46   47                                       
CONECT    8   10    9    7   48                                       
CONECT    9    8   49   50   51                                       
CONECT   10   12    8   11   52                                       
CONECT   11   10   53                                                 
CONECT   12   14   13   10   54                                       
CONECT   13   12   55   56   57                                       
CONECT   14   16   15   15   12                                       
CONECT   15   14   14                                                 
CONECT   16   17   18   14   58                                       
CONECT   17   16   59   60   61                                       
CONECT   18   16   19   19   62                                       
CONECT   19   21   18   18   20                                       
CONECT   20   19   63   64   65                                       
CONECT   21   22   22   19   66                                       
CONECT   22   23   21   21   67                                       
CONECT   23   22   24   68   69                                       
CONECT   24   23   26   25   70                                       
CONECT   25   24   71   72   73                                       
CONECT   26   27   27   24   74                                       
CONECT   27   28   26   26   30                                       
CONECT   28   29   27   75   76                                       
CONECT   29   28   77   78   79                                       
CONECT   30   27   31   31   80                                       
CONECT   31   30   30   32   81                                       
CONECT   32   33   31   34   82                                       
CONECT   33   32   83                                                 
CONECT   34   32   35   36   84                                       
CONECT   35   34   85   86   87                                       
CONECT   36   37   34   88   89                                       
CONECT   37   36   38   90   91                                       
CONECT   38   37   40   40   39                                       
CONECT   39   38   92                                                 
CONECT   40   38   38                                                 
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50    9                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   12                                                      
CONECT   55   13                                                      
CONECT   56   13                                                      
CONECT   57   13                                                      
CONECT   58   16                                                      
CONECT   59   17                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   20                                                      
CONECT   64   20                                                      
CONECT   65   20                                                      
CONECT   66   21                                                      
CONECT   67   22                                                      
CONECT   68   23                                                      
CONECT   69   23                                                      
CONECT   70   24                                                      
CONECT   71   25                                                      
CONECT   72   25                                                      
CONECT   73   25                                                      
CONECT   74   26                                                      
CONECT   75   28                                                      
CONECT   76   28                                                      
CONECT   77   29                                                      
CONECT   78   29                                                      
CONECT   79   29                                                      
CONECT   80   30                                                      
CONECT   81   31                                                      
CONECT   82   32                                                      
CONECT   83   33                                                      
CONECT   84   34                                                      
CONECT   85   35                                                      
CONECT   86   35                                                      
CONECT   87   35                                                      
CONECT   88   36                                                      
CONECT   89   36                                                      
CONECT   90   37                                                      
CONECT   91   37                                                      
CONECT   92   39                                                      
MASTER        0    0    0    0    0    0    0    0   92    0   92    0
END
