########## Name:		UNNAMED
########## Grid Score:          -28.794184
##########          vdw:          -22.208521
##########           es:           -6.585662
##########

@<TRIPOS>MOLECULE
UNNAMED
 20 20 1 0 0
BIOPOLYMER
GAST_HUCK


@<TRIPOS>ATOM
      1 C1         14.2709   56.6362   55.3816 C.3     1  ARA1        0.1850
      2 H1         14.2353   55.6001   55.7487 H       1  ARA1        0.0935
      3 O5         15.2394   56.7397   54.3240 O.3     1  ARA1       -0.3462
      4 C5         14.9424   55.7887   53.2379 C.3     1  ARA1        0.0792
      5 H6         14.8353   54.7725   53.6449 H       1  ARA1        0.0587
      6 H5         15.7508   55.8015   52.4930 H       1  ARA1        0.0587
      7 C4         13.6339   56.2375   52.5982 C.3     1  ARA1        0.1069
      8 H4         13.3702   55.5102   51.8167 H       1  ARA1        0.0643
      9 O4         13.7487   57.5242   51.9689 O.3     1  ARA1       -0.3869
     10 H10        13.0554   57.6266   51.3277 H       1  ARA1        0.2100
     11 C3         12.5232   56.2203   53.6602 C.3     1  ARA1        0.1137
     12 H3         12.3779   55.1854   54.0043 H       1  ARA1        0.0647
     13 O3         11.3153   56.6709   53.0582 O.3     1  ARA1       -0.3864
     14 H9         10.5815   56.4618   53.6248 H       1  ARA1        0.2100
     15 C2         12.9098   57.0721   54.8689 C.3     1  ARA1        0.1339
     16 H2         12.9815   58.1204   54.5445 H       1  ARA1        0.0671
     17 O2         11.9168   56.9945   55.8976 O.3     1  ARA1       -0.3841
     18 H8         12.1739   57.5453   56.6275 H       1  ARA1        0.2101
     19 O1         14.5687   57.5120   56.4257 O.3     1  ARA1       -0.3649
     20 H7         15.4961   57.4612   56.6267 H       1  ARA1        0.2126
@<TRIPOS>BOND
     1     1     2    1
     2     1     3    1
     3     1    15    1
     4     1    19    1
     5     3     4    1
     6     4     5    1
     7     4     6    1
     8     4     7    1
     9     7     8    1
    10     7     9    1
    11     7    11    1
    12     9    10    1
    13    11    12    1
    14    11    13    1
    15    11    15    1
    16    13    14    1
    17    15    16    1
    18    15    17    1
    19    17    18    1
    20    19    20    1
@<TRIPOS>SUBSTRUCTURE
     1 ARA1        1 TEMP              0 ****  ****    0 ROOT