COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0       9.807  -0.779   1.984  1.00  0.00           C  
ATOM      2  CA  VAL A   1       1.855  -0.122  -1.207  1.00  0.00           C  
ATOM      3  C   VAL A   1       0.648  -0.306  -0.324  1.00  0.00           C  
HETATM    4  C   UNK A   2      -2.934   2.869   0.099  1.00  0.00           C  
HETATM    5  C   UNK A   2      -1.681   0.150   0.230  1.00  0.00           C  
HETATM    6  C   UNK A   2      -2.952   0.399  -0.540  1.00  0.00           C  
HETATM    7  C   UNK A   3      -5.381   0.550  -0.667  1.00  0.00           C  
HETATM    8  C   UNK A   3      -6.540  -0.184   0.011  1.00  0.00           C  
HETATM    9  C   UNK A   0       9.498  -1.515   0.855  1.00  0.00           C  
HETATM   10  C   UNK A   3      -6.305  -1.694  -0.072  1.00  0.00           C  
HETATM   11  C   UNK A   3      -7.479  -2.460   0.580  1.00  0.00           C  
HETATM   12  C   UNK A   3      -6.959  -2.668   2.020  1.00  0.00           C  
HETATM   13  C   UNK A   3      -5.100  -2.088   0.753  1.00  0.00           C  
HETATM   14  C   UNK A   0       8.459  -1.118   0.034  1.00  0.00           C  
ATOM     15  CB  VAL A   1       1.753  -1.061  -2.411  1.00  0.00           C  
ATOM     16  CG1 VAL A   1       1.587  -2.501  -1.923  1.00  0.00           C  
ATOM     17  CG2 VAL A   1       0.545  -0.668  -3.263  1.00  0.00           C  
HETATM   18  C   UNK A   2      -1.536   1.204   1.330  1.00  0.00           C  
HETATM   19  C   UNK A   2      -1.555   2.600   0.705  1.00  0.00           C  
HETATM   20  C   UNK A   2      -0.491   2.682  -0.393  1.00  0.00           C  
HETATM   21  C   UNK A   2      -1.258   3.645   1.782  1.00  0.00           C  
HETATM   22  C   UNK A   0       7.728   0.014   0.342  1.00  0.00           C  
HETATM   23  C   UNK A   0       8.036   0.750   1.471  1.00  0.00           C  
HETATM   24  C   UNK A   0       9.076   0.353   2.292  1.00  0.00           C  
HETATM   25  C   UNK A   0       6.596   0.448  -0.553  1.00  0.00           C  
HETATM   26  C   UNK A   3      -5.675   2.051  -0.694  1.00  0.00           C  
HETATM   27  C   UNK A   0       4.247   0.111  -0.807  1.00  0.00           C  
ATOM     28  N   VAL A   1       3.068  -0.433  -0.447  1.00  0.00           N  
HETATM   29  N   UNK A   2      -0.535   0.233  -0.680  1.00  0.00           N  
HETATM   30  N   UNK A   3      -4.145   0.308   0.082  1.00  0.00           N  
HETATM   31  N   UNK A   3      -5.495  -2.636   1.916  1.00  0.00           N  
HETATM   32  O   UNK A   3      -3.946  -1.934   0.415  1.00  0.00           O  
HETATM   33  O   UNK A   0       4.304   0.860  -1.763  1.00  0.00           O  
ATOM     34  O   VAL A   1       0.741  -0.938   0.706  1.00  0.00           O  
HETATM   35  O   UNK A   2      -2.902   0.681  -1.718  1.00  0.00           O  
HETATM   36  O   UNK A   0       5.362  -0.174  -0.109  1.00  0.00           O  
HETATM   37  O   UNK A   3      -5.941   2.509   0.633  1.00  0.00           O  
HETATM   38  H   UNK A   0      10.615  -1.092   2.628  1.00  0.00           H  
ATOM     39  HA  VAL A   1       1.898   0.910  -1.554  1.00  0.00           H  
HETATM   40  H   UNK A   2      -3.706   2.543   0.795  1.00  0.00           H  
HETATM   41  H   UNK A   2      -3.045   3.937  -0.092  1.00  0.00           H  
HETATM   42  H   UNK A   2      -3.033   2.320  -0.837  1.00  0.00           H  
HETATM   43  H   UNK A   2      -1.717  -0.842   0.679  1.00  0.00           H  
HETATM   44  H   UNK A   3      -5.266   0.184  -1.687  1.00  0.00           H  
HETATM   45  H   UNK A   3      -6.598   0.117   1.057  1.00  0.00           H  
HETATM   46  H   UNK A   3      -7.473   0.067  -0.492  1.00  0.00           H  
HETATM   47  H   UNK A   0      10.068  -2.400   0.614  1.00  0.00           H  
HETATM   48  H   UNK A   3      -6.175  -2.002  -1.109  1.00  0.00           H  
HETATM   49  H   UNK A   3      -8.388  -1.859   0.577  1.00  0.00           H  
HETATM   50  H   UNK A   3      -7.644  -3.417   0.084  1.00  0.00           H  
HETATM   51  H   UNK A   3      -7.308  -1.863   2.667  1.00  0.00           H  
HETATM   52  H   UNK A   3      -7.288  -3.633   2.405  1.00  0.00           H  
HETATM   53  H   UNK A   0       8.218  -1.692  -0.848  1.00  0.00           H  
ATOM     54  HB  VAL A   1       2.661  -0.983  -3.010  1.00  0.00           H  
ATOM     55 HG11 VAL A   1       0.679  -2.579  -1.324  1.00  0.00           H  
ATOM     56 HG12 VAL A   1       1.514  -3.170  -2.780  1.00  0.00           H  
ATOM     57 HG13 VAL A   1       2.448  -2.781  -1.316  1.00  0.00           H  
ATOM     58 HG21 VAL A   1      -0.362  -0.738  -2.662  1.00  0.00           H  
ATOM     59 HG22 VAL A   1       0.667   0.355  -3.618  1.00  0.00           H  
ATOM     60 HG23 VAL A   1       0.467  -1.342  -4.117  1.00  0.00           H  
HETATM   61  H   UNK A   2      -2.363   1.110   2.034  1.00  0.00           H  
HETATM   62  H   UNK A   2      -0.593   1.054   1.855  1.00  0.00           H  
HETATM   63  H   UNK A   2      -0.270   3.727  -0.607  1.00  0.00           H  
HETATM   64  H   UNK A   2       0.416   2.180  -0.057  1.00  0.00           H  
HETATM   65  H   UNK A   2      -0.862   2.197  -1.295  1.00  0.00           H  
HETATM   66  H   UNK A   2      -2.016   3.587   2.563  1.00  0.00           H  
HETATM   67  H   UNK A   2      -0.275   3.454   2.213  1.00  0.00           H  
HETATM   68  H   UNK A   2      -1.271   4.640   1.336  1.00  0.00           H  
HETATM   69  H   UNK A   0       7.466   1.634   1.712  1.00  0.00           H  
HETATM   70  H   UNK A   0       9.315   0.926   3.176  1.00  0.00           H  
HETATM   71  H   UNK A   0       6.493   1.532  -0.510  1.00  0.00           H  
HETATM   72  H   UNK A   0       6.807   0.144  -1.579  1.00  0.00           H  
HETATM   73  H   UNK A   3      -4.813   2.583  -1.096  1.00  0.00           H  
HETATM   74  H   UNK A   3      -6.544   2.240  -1.324  1.00  0.00           H  
ATOM     75  H   VAL A   1       3.023  -1.031   0.316  1.00  0.00           H  
HETATM   76  H   UNK A   2      -0.628   0.676  -1.538  1.00  0.00           H  
HETATM   77  H   UNK A   3      -4.185   0.083   1.024  1.00  0.00           H  
HETATM   78  H   UNK A   3      -4.890  -2.967   2.598  1.00  0.00           H  
HETATM   79  H   UNK A   3      -6.136   3.454   0.691  1.00  0.00           H  
CONECT    1    9    9   24   38                                       
CONECT    2   15    3   28   39                                       
CONECT    3    2   29   34   34                                       
CONECT    4   19   40   41   42                                       
CONECT    5   29   18    6   43                                       
CONECT    6   35   35    5   30                                       
CONECT    7   30   26    8   44                                       
CONECT    8    7   10   45   46                                       
CONECT    9    1    1   14   47                                       
CONECT   10   11    8   13   48                                       
CONECT   11   12   10   49   50                                       
CONECT   12   11   31   51   52                                       
CONECT   13   10   31   32   32                                       
CONECT   14    9   22   22   53                                       
CONECT   15   16   17    2   54                                       
CONECT   16   15   55   56   57                                       
CONECT   17   15   58   59   60                                       
CONECT   18   19    5   61   62                                       
CONECT   19    4   18   21   20                                       
CONECT   20   19   63   64   65                                       
CONECT   21   19   66   67   68                                       
CONECT   22   14   14   23   25                                       
CONECT   23   24   24   22   69                                       
CONECT   24    1   23   23   70                                       
CONECT   25   22   36   71   72                                       
CONECT   26    7   37   73   74                                       
CONECT   27   33   33   28   36                                       
CONECT   28    2   27   75                                            
CONECT   29    3    5   76                                            
CONECT   30    6    7   77                                            
CONECT   31   12   13   78                                            
CONECT   32   13   13                                                 
CONECT   33   27   27                                                 
CONECT   34    3    3                                                 
CONECT   35    6    6                                                 
CONECT   36   27   25                                                 
CONECT   37   26   79                                                 
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   11                                                      
CONECT   50   11                                                      
CONECT   51   12                                                      
CONECT   52   12                                                      
CONECT   53   14                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   16                                                      
CONECT   57   16                                                      
CONECT   58   17                                                      
CONECT   59   17                                                      
CONECT   60   17                                                      
CONECT   61   18                                                      
CONECT   62   18                                                      
CONECT   63   20                                                      
CONECT   64   20                                                      
CONECT   65   20                                                      
CONECT   66   21                                                      
CONECT   67   21                                                      
CONECT   68   21                                                      
CONECT   69   23                                                      
CONECT   70   24                                                      
CONECT   71   25                                                      
CONECT   72   25                                                      
CONECT   73   26                                                      
CONECT   74   26                                                      
CONECT   75   28                                                      
CONECT   76   29                                                      
CONECT   77   30                                                      
CONECT   78   31                                                      
CONECT   79   37                                                      
MASTER        0    0    0    0    0    0    0    0   79    0   79    0
END
