REMARK  Name = BDB054136
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.490   2.551  -0.437  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1       -1.595   1.333  -0.378  0.00  0.00    +0.259 A 
ATOM      3  C   LIG    1       -0.437   0.461  -0.108  0.00  0.00    +0.067 A 
ATOM      4  C   LIG    1       -0.670  -0.919  -0.062  0.00  0.00    +0.078 A 
ATOM      5  C   LIG    1        0.406  -1.773   0.191  0.00  0.00    +0.031 A 
ATOM      6  C   LIG    1        1.692  -1.260   0.395  0.00  0.00    +0.035 A 
ATOM      7  C   LIG    1        1.902   0.126   0.344  0.00  0.00    +0.127 A 
ATOM      8  N   LIG    1       -1.943  -1.476  -0.261  0.00  0.00    -0.237 NA
ATOM      9  C   LIG    1       -2.920  -0.668  -0.493  0.00  0.00    +0.199 A 
ATOM     10  C   LIG    1        0.839   0.999   0.092  0.00  0.00    +0.048 A 
ATOM     11  N   LIG    1       -2.792   0.689  -0.557  0.00  0.00    -0.313 N 
ATOM     12  H   LIG    1       -3.592   1.276  -0.743  0.00  0.00    +0.170 HD
ENDROOT
BRANCH   7  13
ATOM     13  N   LIG    1        3.252   0.664   0.559  0.00  0.00    +0.056 N 
ATOM     14  O   LIG    1        4.165  -0.144   0.779  0.00  0.00    -0.126 OA
ATOM     15  O   LIG    1        3.397   1.893   0.506  0.00  0.00    -0.126 OA
ENDBRANCH   7  13
TORSDOF 1