REMARK  Name = BDB062573
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.161   0.018  -0.016  0.00  0.00    +0.182 A 
ATOM      2  N   LIG    1        0.635   1.058   0.278  0.00  0.00    -0.145 NA
ATOM      3  N   LIG    1        1.876   0.530   0.184  0.00  0.00    -0.219 N 
ATOM      4  C   LIG    1        1.773  -0.816  -0.165  0.00  0.00    +0.156 A 
ATOM      5  C   LIG    1        2.977  -1.556  -0.315  0.00  0.00    +0.049 A 
ATOM      6  C   LIG    1        4.162  -0.945  -0.117  0.00  0.00    +0.020 A 
ATOM      7  C   LIG    1        4.240   0.465   0.248  0.00  0.00    +0.036 A 
ATOM      8 BR   LIG    1        5.919   1.224   0.500  0.00  0.00    -0.049 Br
ATOM      9  C   LIG    1        3.100   1.161   0.388  0.00  0.00    +0.130 A 
ATOM     10  N   LIG    1        0.512  -1.150  -0.294  0.00  0.00    -0.207 NA
ENDROOT
BRANCH   1  15
ATOM     11  F   LIG    1       -5.751   0.289  -0.137  0.00  0.00    -0.205 F 
ATOM     12  C   LIG    1       -4.414   0.227  -0.107  0.00  0.00    +0.123 A 
ATOM     13  C   LIG    1       -3.682   1.364   0.210  0.00  0.00    +0.039 A 
ATOM     14  C   LIG    1       -2.286   1.299   0.241  0.00  0.00    +0.014 A 
ATOM     15  C   LIG    1       -1.620   0.096  -0.046  0.00  0.00    +0.021 A 
ATOM     16  C   LIG    1       -2.382  -1.041  -0.364  0.00  0.00    +0.014 A 
ATOM     17  C   LIG    1       -3.778  -0.975  -0.395  0.00  0.00    +0.039 A 
ENDBRANCH   1  15
TORSDOF 1