COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      10.377   0.545  -1.062  1.00  0.00           C  
HETATM    2  O   UNK A   0      10.092  -0.470  -0.464  1.00  0.00           O  
HETATM    3  C   UNK A   0      11.639   0.606  -1.883  1.00  0.00           C  
HETATM    4  N   UNK A   0       9.562   1.617  -0.998  1.00  0.00           N  
HETATM    5  C   UNK A   0       8.303   1.691  -0.243  1.00  0.00           C  
HETATM    6  C   UNK A   0       7.347   0.636  -0.735  1.00  0.00           C  
HETATM    7  O   UNK A   0       7.519   0.120  -1.820  1.00  0.00           O  
HETATM    8  C   UNK A   0       7.706   3.094  -0.485  1.00  0.00           C  
HETATM    9  C   UNK A   0       8.376   3.532  -1.815  1.00  0.00           C  
HETATM   10  C   UNK A   0       9.789   2.910  -1.668  1.00  0.00           C  
ATOM     11  N   LEU A   1       6.301   0.265   0.029  1.00  0.00           N  
ATOM     12  CA  LEU A   1       5.371  -0.761  -0.450  1.00  0.00           C  
ATOM     13  C   LEU A   1       4.032  -0.576   0.217  1.00  0.00           C  
ATOM     14  O   LEU A   1       3.870   0.324   1.013  1.00  0.00           O  
ATOM     15  CB  LEU A   1       5.923  -2.147  -0.110  1.00  0.00           C  
ATOM     16  CG  LEU A   1       7.220  -2.384  -0.885  1.00  0.00           C  
ATOM     17  CD1 LEU A   1       7.837  -3.716  -0.452  1.00  0.00           C  
ATOM     18  CD2 LEU A   1       6.919  -2.424  -2.384  1.00  0.00           C  
HETATM   19  C   UNK A   2       1.169   0.134   0.241  1.00  0.00           C  
HETATM   20  N   UNK A   2       3.014  -1.411  -0.072  1.00  0.00           N  
HETATM   21  O   UNK A   2       1.918   1.007  -0.144  1.00  0.00           O  
HETATM   22  C   UNK A   2       1.713  -1.232   0.575  1.00  0.00           C  
HETATM   23  C   UNK A   2       1.876  -1.358   2.091  1.00  0.00           C  
HETATM   24  C   UNK A   2       2.302  -2.762   2.435  1.00  0.00           C  
HETATM   25  C   UNK A   2       0.025  -3.746   2.935  1.00  0.00           C  
HETATM   26  C   UNK A   2      -0.620  -3.987   1.569  1.00  0.00           C  
HETATM   27  C   UNK A   2      -2.143  -3.934   1.708  1.00  0.00           C  
HETATM   28  C   UNK A   2      -2.788  -4.176   0.342  1.00  0.00           C  
HETATM   29  C   UNK A   2      -4.311  -4.123   0.481  1.00  0.00           C  
HETATM   30  C   UNK A   2      -4.956  -4.364  -0.886  1.00  0.00           C  
HETATM   31  C   UNK A   2      -6.479  -4.312  -0.747  1.00  0.00           C  
HETATM   32  C   UNK A   2      -7.124  -4.553  -2.113  1.00  0.00           C  
HETATM   33  C   UNK A   2      -8.624  -4.501  -1.976  1.00  0.00           C  
HETATM   34  C   UNK A   2      -9.332  -5.654  -1.690  1.00  0.00           C  
HETATM   35  C   UNK A   2     -10.708  -5.606  -1.565  1.00  0.00           C  
HETATM   36  C   UNK A   2     -11.376  -4.406  -1.725  1.00  0.00           C  
HETATM   37  C   UNK A   2     -10.667  -3.254  -2.010  1.00  0.00           C  
HETATM   38  C   UNK A   2      -9.291  -3.300  -2.131  1.00  0.00           C  
HETATM   39  N   UNK A   2       1.483  -3.796   2.803  1.00  0.00           N  
HETATM   40  C   UNK A   2       3.560  -3.242   2.435  1.00  0.00           C  
HETATM   41  C   UNK A   2       2.271  -4.871   3.019  1.00  0.00           C  
HETATM   42  N   UNK A   2       3.511  -4.533   2.797  1.00  0.00           N  
HETATM   43  N   UNK A   3      -0.148   0.385   0.369  1.00  0.00           N  
HETATM   44  C   UNK A   3      -0.677   1.712   0.044  1.00  0.00           C  
HETATM   45  C   UNK A   3      -1.955   1.945   0.807  1.00  0.00           C  
HETATM   46  O   UNK A   3      -2.383   1.087   1.550  1.00  0.00           O  
HETATM   47  C   UNK A   3      -0.957   1.795  -1.458  1.00  0.00           C  
HETATM   48  O   UNK A   3      -1.999   0.880  -1.799  1.00  0.00           O  
HETATM   49  N   UNK A   3      -2.623   3.107   0.665  1.00  0.00           N  
HETATM   50  C   UNK A   3      -3.865   3.333   1.407  1.00  0.00           C  
HETATM   51  C   UNK A   3      -4.087   4.837   1.584  1.00  0.00           C  
HETATM   52  C   UNK A   3      -2.858   5.458   2.249  1.00  0.00           C  
HETATM   53  O   UNK A   3      -4.294   5.442   0.306  1.00  0.00           O  
HETATM   54  P   UNK A   3      -5.641   6.234  -0.081  1.00  0.00           P  
HETATM   55  O   UNK A   3      -6.812   5.356   0.143  1.00  0.00           O  
HETATM   56  O   UNK A   3      -5.773   7.549   0.837  1.00  0.00           O  
HETATM   57  O   UNK A   3      -5.583   6.665  -1.631  1.00  0.00           O  
HETATM   58  C   UNK A   3      -5.022   2.742   0.642  1.00  0.00           C  
HETATM   59  O   UNK A   3      -4.827   2.186  -0.418  1.00  0.00           O  
HETATM   60  N   UNK A   3      -6.272   2.830   1.137  1.00  0.00           N  
HETATM   61  H   UNK A   0      11.426   0.282  -2.902  1.00  0.00           H  
HETATM   62  H   UNK A   0      12.014   1.630  -1.899  1.00  0.00           H  
HETATM   63  H   UNK A   0      12.391  -0.049  -1.444  1.00  0.00           H  
HETATM   64  H   UNK A   0       8.499   1.548   0.819  1.00  0.00           H  
HETATM   65  H   UNK A   0       6.624   3.038  -0.598  1.00  0.00           H  
HETATM   66  H   UNK A   0       7.976   3.773   0.324  1.00  0.00           H  
HETATM   67  H   UNK A   0       7.849   3.115  -2.673  1.00  0.00           H  
HETATM   68  H   UNK A   0       8.434   4.618  -1.884  1.00  0.00           H  
HETATM   69  H   UNK A   0      10.425   3.549  -1.055  1.00  0.00           H  
HETATM   70  H   UNK A   0      10.239   2.756  -2.649  1.00  0.00           H  
ATOM     71  H   LEU A   1       6.163   0.677   0.896  1.00  0.00           H  
ATOM     72  HA  LEU A   1       5.255  -0.671  -1.530  1.00  0.00           H  
ATOM     73  HB1 LEU A   1       6.122  -2.207   0.960  1.00  0.00           H  
ATOM     74  HB2 LEU A   1       5.191  -2.907  -0.386  1.00  0.00           H  
ATOM     75  HG  LEU A   1       7.920  -1.575  -0.677  1.00  0.00           H  
ATOM     76 HD11 LEU A   1       7.137  -4.525  -0.660  1.00  0.00           H  
ATOM     77 HD12 LEU A   1       8.762  -3.884  -1.004  1.00  0.00           H  
ATOM     78 HD13 LEU A   1       8.052  -3.687   0.616  1.00  0.00           H  
ATOM     79 HD21 LEU A   1       6.480  -1.476  -2.692  1.00  0.00           H  
ATOM     80 HD22 LEU A   1       7.844  -2.593  -2.936  1.00  0.00           H  
ATOM     81 HD23 LEU A   1       6.219  -3.234  -2.592  1.00  0.00           H  
HETATM   82  H   UNK A   2       3.144  -2.132  -0.709  1.00  0.00           H  
HETATM   83  H   UNK A   2       1.021  -1.995   0.219  1.00  0.00           H  
HETATM   84  H   UNK A   2       2.633  -0.654   2.435  1.00  0.00           H  
HETATM   85  H   UNK A   2       0.926  -1.137   2.579  1.00  0.00           H  
HETATM   86  H   UNK A   2      -0.272  -2.766   3.310  1.00  0.00           H  
HETATM   87  H   UNK A   2      -0.303  -4.516   3.633  1.00  0.00           H  
HETATM   88  H   UNK A   2      -0.292  -3.217   0.871  1.00  0.00           H  
HETATM   89  H   UNK A   2      -0.323  -4.967   1.195  1.00  0.00           H  
HETATM   90  H   UNK A   2      -2.471  -4.705   2.406  1.00  0.00           H  
HETATM   91  H   UNK A   2      -2.440  -2.955   2.082  1.00  0.00           H  
HETATM   92  H   UNK A   2      -2.460  -3.405  -0.356  1.00  0.00           H  
HETATM   93  H   UNK A   2      -2.491  -5.155  -0.032  1.00  0.00           H  
HETATM   94  H   UNK A   2      -4.639  -4.893   1.179  1.00  0.00           H  
HETATM   95  H   UNK A   2      -4.608  -3.144   0.855  1.00  0.00           H  
HETATM   96  H   UNK A   2      -4.628  -3.594  -1.583  1.00  0.00           H  
HETATM   97  H   UNK A   2      -4.659  -5.344  -1.260  1.00  0.00           H  
HETATM   98  H   UNK A   2      -6.807  -5.082  -0.049  1.00  0.00           H  
HETATM   99  H   UNK A   2      -6.776  -3.332  -0.373  1.00  0.00           H  
HETATM  100  H   UNK A   2      -6.796  -3.783  -2.811  1.00  0.00           H  
HETATM  101  H   UNK A   2      -6.827  -5.533  -2.487  1.00  0.00           H  
HETATM  102  H   UNK A   2      -8.811  -6.591  -1.565  1.00  0.00           H  
HETATM  103  H   UNK A   2     -11.261  -6.506  -1.342  1.00  0.00           H  
HETATM  104  H   UNK A   2     -12.451  -4.369  -1.628  1.00  0.00           H  
HETATM  105  H   UNK A   2     -11.189  -2.316  -2.136  1.00  0.00           H  
HETATM  106  H   UNK A   2      -8.738  -2.399  -2.350  1.00  0.00           H  
HETATM  107  H   UNK A   2       4.451  -2.686   2.186  1.00  0.00           H  
HETATM  108  H   UNK A   2       1.930  -5.850   3.323  1.00  0.00           H  
HETATM  109  H   UNK A   3      -0.747  -0.313   0.677  1.00  0.00           H  
HETATM  110  H   UNK A   3       0.055   2.472   0.320  1.00  0.00           H  
HETATM  111  H   UNK A   3      -1.265   2.809  -1.714  1.00  0.00           H  
HETATM  112  H   UNK A   3      -0.053   1.540  -2.011  1.00  0.00           H  
HETATM  113  H   UNK A   3      -2.230   0.879  -2.738  1.00  0.00           H  
HETATM  114  H   UNK A   3      -2.281   3.793   0.071  1.00  0.00           H  
HETATM  115  H   UNK A   3      -3.796   2.858   2.385  1.00  0.00           H  
HETATM  116  H   UNK A   3      -4.963   5.003   2.211  1.00  0.00           H  
HETATM  117  H   UNK A   3      -1.982   5.292   1.622  1.00  0.00           H  
HETATM  118  H   UNK A   3      -3.015   6.530   2.375  1.00  0.00           H  
HETATM  119  H   UNK A   3      -2.700   4.997   3.224  1.00  0.00           H  
HETATM  120  H   UNK A   3      -5.038   8.171   0.742  1.00  0.00           H  
HETATM  121  H   UNK A   3      -6.364   7.148  -1.934  1.00  0.00           H  
HETATM  122  H   UNK A   3      -6.428   3.275   1.985  1.00  0.00           H  
HETATM  123  H   UNK A   3      -7.017   2.450   0.645  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   61   62   63                                       
CONECT    4    5   10    1                                            
CONECT    5    4    6    8   64                                       
CONECT    6    5    7    7   11                                       
CONECT    7    6    6                                                 
CONECT    8    5    9   65   66                                       
CONECT    9    8   10   67   68                                       
CONECT   10    4    9   69   70                                       
CONECT   11   12   71    6                                            
CONECT   12   11   13   15   72                                       
CONECT   13   12   14   14   20                                       
CONECT   14   13   13                                                 
CONECT   15   12   16   73   74                                       
CONECT   16   15   17   18   75                                       
CONECT   17   16   76   77   78                                       
CONECT   18   16   79   80   81                                       
CONECT   19   21   21   22   43                                       
CONECT   20   22   82   13                                            
CONECT   21   19   19                                                 
CONECT   22   19   20   23   83                                       
CONECT   23   22   24   84   85                                       
CONECT   24   23   40   40   39                                       
CONECT   25   39   26   86   87                                       
CONECT   26   25   27   88   89                                       
CONECT   27   26   28   90   91                                       
CONECT   28   27   29   92   93                                       
CONECT   29   28   30   94   95                                       
CONECT   30   29   31   96   97                                       
CONECT   31   30   32   98   99                                       
CONECT   32   31   33  100  101                                       
CONECT   33   32   38   38   34                                       
CONECT   34   33   35   35  102                                       
CONECT   35   34   34   36  103                                       
CONECT   36   35   37   37  104                                       
CONECT   37   36   36   38  105                                       
CONECT   38   33   33   37  106                                       
CONECT   39   24   25   41                                            
CONECT   40   24   24   42  107                                       
CONECT   41   39   42   42  108                                       
CONECT   42   40   41   41                                            
CONECT   43   44  109   19                                            
CONECT   44   43   45   47  110                                       
CONECT   45   44   46   46   49                                       
CONECT   46   45   45                                                 
CONECT   47   44   48  111  112                                       
CONECT   48   47  113                                                 
CONECT   49   50  114   45                                            
CONECT   50   49   51   58  115                                       
CONECT   51   50   52   53  116                                       
CONECT   52   51  117  118  119                                       
CONECT   53   51   54                                                 
CONECT   54   53   55   55   56                                       
CONECT   54   57                                                      
CONECT   55   54   54                                                 
CONECT   56   54  120                                                 
CONECT   57   54  121                                                 
CONECT   58   50   59   59   60                                       
CONECT   59   58   58                                                 
CONECT   60  122  123   58                                            
CONECT   61    3                                                      
CONECT   62    3                                                      
CONECT   63    3                                                      
CONECT   64    5                                                      
CONECT   65    8                                                      
CONECT   66    8                                                      
CONECT   67    9                                                      
CONECT   68    9                                                      
CONECT   69   10                                                      
CONECT   70   10                                                      
CONECT   71   11                                                      
CONECT   72   12                                                      
CONECT   73   15                                                      
CONECT   74   15                                                      
CONECT   75   16                                                      
CONECT   76   17                                                      
CONECT   77   17                                                      
CONECT   78   17                                                      
CONECT   79   18                                                      
CONECT   80   18                                                      
CONECT   81   18                                                      
CONECT   82   20                                                      
CONECT   83   22                                                      
CONECT   84   23                                                      
CONECT   85   23                                                      
CONECT   86   25                                                      
CONECT   87   25                                                      
CONECT   88   26                                                      
CONECT   89   26                                                      
CONECT   90   27                                                      
CONECT   91   27                                                      
CONECT   92   28                                                      
CONECT   93   28                                                      
CONECT   94   29                                                      
CONECT   95   29                                                      
CONECT   96   30                                                      
CONECT   97   30                                                      
CONECT   98   31                                                      
CONECT   99   31                                                      
CONECT  100   32                                                      
CONECT  101   32                                                      
CONECT  102   34                                                      
CONECT  103   35                                                      
CONECT  104   36                                                      
CONECT  105   37                                                      
CONECT  106   38                                                      
CONECT  107   40                                                      
CONECT  108   41                                                      
CONECT  109   43                                                      
CONECT  110   44                                                      
CONECT  111   47                                                      
CONECT  112   47                                                      
CONECT  113   48                                                      
CONECT  114   49                                                      
CONECT  115   50                                                      
CONECT  116   51                                                      
CONECT  117   52                                                      
CONECT  118   52                                                      
CONECT  119   52                                                      
CONECT  120   56                                                      
CONECT  121   57                                                      
CONECT  122   60                                                      
CONECT  123   60                                                      
MASTER        0    0    0    0    0    0    0    0  123    0  123    0
END
