REMARK  Name = BDB018634
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.515  -0.491  -0.169  0.00  0.00    -0.281 N 
ATOM      2  C   LIG    1        0.160   0.664  -0.536  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -0.313   1.698  -0.966  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        1.583   0.426  -0.271  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1        1.706  -0.822   0.337  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1        2.951  -1.298   0.706  0.00  0.00    +0.006 A 
ATOM      7  C   LIG    1        4.067  -0.493   0.446  0.00  0.00    +0.000 A 
ATOM      8  C   LIG    1        3.927   0.767  -0.166  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1        2.667   1.243  -0.532  0.00  0.00    +0.013 A 
ATOM     10  C   LIG    1        0.359  -1.440   0.507  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -4.452   1.678  -1.272  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -3.633   1.014  -0.657  0.00  0.00    +0.221 C 
ATOM     13  N   LIG    1       -3.417   1.095   0.678  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -3.880   1.766   1.270  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -2.467   0.236   1.122  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -2.080   0.143   2.278  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -1.963  -0.579  -0.058  0.00  0.00    +0.172 C 
ATOM     18  C   LIG    1       -2.761  -0.054  -1.250  0.00  0.00    +0.128 C 
ENDBRANCH   1  17
TORSDOF 1