REMARK  Name = BDB002507
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.590   0.758   0.224  0.00  0.00    +0.155 A 
ATOM      2  C   LIG    1        1.484   1.554   0.537  0.00  0.00    +0.165 A 
ATOM      3  F   LIG    1        1.647   2.860   0.801  0.00  0.00    -0.202 F 
ATOM      4  C   LIG    1        0.195   1.027   0.585  0.00  0.00    +0.052 A 
ATOM      5  C   LIG    1       -0.017  -0.328   0.314  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        1.087  -1.133  -0.000  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        2.382  -0.595  -0.045  0.00  0.00    +0.049 A 
ENDROOT
BRANCH   5   8
ATOM      8  C   LIG    1       -1.367  -0.890   0.352  0.00  0.00    +0.058 A 
ATOM      9  N   LIG    1       -2.412  -0.352  -0.376  0.00  0.00    -0.318 N 
ATOM     10  C   LIG    1       -3.577  -1.060  -0.311  0.00  0.00    +0.169 A 
ATOM     11  N   LIG    1       -4.566  -0.758  -1.095  0.00  0.00    -0.259 NA
ATOM     12  C   LIG    1       -3.995   0.416  -1.849  0.00  0.00    +0.166 C 
ATOM     13  S   LIG    1       -3.443  -2.360   0.848  0.00  0.00    -0.058 S 
ATOM     14  C   LIG    1       -2.484   0.520  -1.510  0.00  0.00    +0.147 C 
ATOM     15  C   LIG    1       -1.738  -1.958   1.090  0.00  0.00    +0.075 A 
ENDBRANCH   5   8
BRANCH   1  17
ATOM     16  C   LIG    1        4.947   0.614  -0.085  0.00  0.00    +0.277 C 
ATOM     17  O   LIG    1        3.798   1.398   0.208  0.00  0.00    -0.492 OA
ENDBRANCH   1  17
TORSDOF 2