REMARK  Name = BDB000535
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.744  -0.885   1.343  0.00  0.00    +0.215 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.617  -0.345   0.222  0.00  0.00    -0.012 A 
ATOM      3  C   LIG    1        1.967   1.017   0.201  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1        2.779   1.531  -0.812  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1        3.264   0.691  -1.811  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1        2.943  -0.663  -1.796  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1        2.131  -1.179  -0.784  0.00  0.00    +0.006 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      8  O   LIG    1       -0.756   0.458   2.666  0.00  0.00    -0.289 OA
ATOM      9  C   LIG    1       -0.541  -0.073   1.572  0.00  0.00    +0.196 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -1.558   0.080   0.484  0.00  0.00    +0.020 A 
ATOM     11  C   LIG    1       -1.570  -0.715  -0.667  0.00  0.00    +0.011 A 
ATOM     12  C   LIG    1       -2.548  -0.520  -1.647  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -3.522   0.462  -1.482  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1       -3.525   1.252  -0.335  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1       -2.549   1.061   0.645  0.00  0.00    +0.011 A 
ENDBRANCH   9  10
ENDBRANCH   1   9
BRANCH   1  16
ATOM     16  O   LIG    1        0.441  -2.269   1.180  0.00  0.00    -0.379 OA
ATOM     17  H   LIG    1        0.081  -2.567   2.035  0.00  0.00    +0.211 HD
ENDBRANCH   1  16
TORSDOF 4