REMARK  Name = BDB062580
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  F   LIG    1       -5.305   1.756   0.044  0.00  0.00    -0.204 F 
ATOM      2  C   LIG    1       -4.177   1.023  -0.008  0.00  0.00    +0.142 A 
ATOM      3  C   LIG    1       -2.972   1.599   0.087  0.00  0.00    +0.153 A 
ATOM      4  N   LIG    1       -1.835   0.799   0.027  0.00  0.00    -0.217 N 
ATOM      5  C   LIG    1       -1.900  -0.587  -0.130  0.00  0.00    +0.157 A 
ATOM      6  N   LIG    1       -0.690  -1.091  -0.155  0.00  0.00    -0.207 NA
ATOM      7  C   LIG    1        0.121   0.012  -0.011  0.00  0.00    +0.182 A 
ATOM      8  C   LIG    1       -3.187  -1.189  -0.231  0.00  0.00    +0.051 A 
ATOM      9  N   LIG    1       -0.539   1.174   0.102  0.00  0.00    -0.145 NA
ATOM     10  C   LIG    1       -4.287  -0.412  -0.172  0.00  0.00    +0.043 A 
ENDROOT
BRANCH   7  11
ATOM     11  C   LIG    1        1.579  -0.100   0.014  0.00  0.00    +0.021 A 
ATOM     12  C   LIG    1        2.388   1.038   0.162  0.00  0.00    +0.013 A 
ATOM     13  C   LIG    1        3.782   0.924   0.185  0.00  0.00    +0.016 A 
ATOM     14  C   LIG    1        4.375  -0.331   0.060  0.00  0.00    +0.018 A 
ATOM     15 BR   LIG    1        6.258  -0.486   0.090  0.00  0.00    -0.050 Br
ATOM     16  C   LIG    1        3.589  -1.471  -0.088  0.00  0.00    +0.016 A 
ATOM     17  C   LIG    1        2.195  -1.354  -0.111  0.00  0.00    +0.013 A 
ENDBRANCH   7  11
TORSDOF 1