REMARK  Name = BDB000540
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.172  -0.987   2.186  0.00  0.00    -0.283 OA
ATOM      2  C   LIG    1        0.506  -0.878   1.012  0.00  0.00    +0.233 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1        1.800  -0.260   0.621  0.00  0.00    +0.026 A 
ATOM      4  C   LIG    1        2.183  -0.105  -0.718  0.00  0.00    +0.013 A 
ATOM      5  C   LIG    1        3.405   0.498  -1.033  0.00  0.00    +0.016 A 
ATOM      6  C   LIG    1        4.244   0.946  -0.013  0.00  0.00    +0.018 A 
ATOM      7 BR   LIG    1        5.893   1.760  -0.445  0.00  0.00    -0.050 Br
ATOM      8  C   LIG    1        3.874   0.797   1.322  0.00  0.00    +0.016 A 
ATOM      9  C   LIG    1        2.653   0.195   1.638  0.00  0.00    +0.013 A 
ENDBRANCH   2   3
BRANCH   2  10
ATOM     10  C   LIG    1       -0.453  -1.358  -0.053  0.00  0.00    +0.233 C 
ATOM     11  O   LIG    1       -0.095  -2.269  -0.790  0.00  0.00    -0.283 OA
BRANCH  10  12
ATOM     12  C   LIG    1       -1.778  -0.700  -0.210  0.00  0.00    +0.026 A 
ATOM     13  C   LIG    1       -2.188   0.360   0.608  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1       -3.439   0.955   0.410  0.00  0.00    +0.016 A 
ATOM     15  C   LIG    1       -4.277   0.492  -0.604  0.00  0.00    +0.018 A 
ATOM     16 BR   LIG    1       -5.965   1.300  -0.867  0.00  0.00    -0.050 Br
ATOM     17  C   LIG    1       -3.879  -0.562  -1.422  0.00  0.00    +0.016 A 
ATOM     18  C   LIG    1       -2.631  -1.158  -1.225  0.00  0.00    +0.013 A 
ENDBRANCH  10  12
ENDBRANCH   2  10
TORSDOF 3