REMARK  Name = BDB008427
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.224   0.176   0.373  0.00  0.00    +0.008 C 
ATOM      2  C   LIG    1       -2.710   0.021   0.497  0.00  0.00    -0.003 C 
ATOM      3  C   LIG    1       -2.000   1.365   0.200  0.00  0.00    +0.057 C 
ATOM      4  C   LIG    1       -0.534   1.124   0.136  0.00  0.00    +0.026 A 
ATOM      5  C   LIG    1        0.078  -0.085  -0.119  0.00  0.00    +0.027 A 
ATOM      6  C   LIG    1       -0.678  -1.277  -0.369  0.00  0.00    +0.071 A 
ATOM      7  N   LIG    1       -0.181  -2.451  -0.589  0.00  0.00    -0.175 NA
ATOM      8  N   LIG    1        1.131  -2.811  -0.619  0.00  0.00    -0.242 N 
ATOM      9  H   LIG    1        1.251  -3.804  -0.806  0.00  0.00    +0.192 HD
ATOM     10  C   LIG    1        2.355  -2.187  -0.493  0.00  0.00    +0.273 A 
ATOM     11  C   LIG    1        2.545  -0.753  -0.226  0.00  0.00    +0.053 A 
ATOM     12  C   LIG    1        3.842  -0.222  -0.115  0.00  0.00    +0.052 A 
ATOM     13  C   LIG    1        4.032   1.128   0.150  0.00  0.00    +0.126 A 
ATOM     14  C   LIG    1        2.962   2.006   0.317  0.00  0.00    +0.064 A 
ATOM     15  C   LIG    1        1.678   1.466   0.204  0.00  0.00    +0.051 A 
ATOM     16  F   LIG    1        5.280   1.605   0.251  0.00  0.00    -0.205 F 
ATOM     17  O   LIG    1        3.367  -2.885  -0.611  0.00  0.00    -0.266 OA
ATOM     18  C   LIG    1        1.461   0.110  -0.067  0.00  0.00    +0.021 A 
ATOM     19  N   LIG    1        0.440   2.065   0.321  0.00  0.00    -0.357 N 
ATOM     20  H   LIG    1        0.288   3.045   0.522  0.00  0.00    +0.166 HD
ATOM     21  C   LIG    1       -2.200  -1.112  -0.425  0.00  0.00    +0.061 C 
ENDROOT
TORSDOF 0