REMARK  Name = BDB056468
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.288  -2.015   1.451  0.00  0.00    +0.046 C 
ATOM      2  C   LIG    1       -2.629  -0.776   0.670  0.00  0.00    -0.024 A 
ATOM      3  C   LIG    1       -1.611   0.021   0.118  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1       -1.972   1.167  -0.599  0.00  0.00    +0.065 A 
ATOM      5  C   LIG    1       -0.888   1.983  -1.170  0.00  0.00    +0.259 A 
ATOM      6  N   LIG    1        0.386   1.548  -0.909  0.00  0.00    -0.306 N 
ATOM      7  H   LIG    1        1.113   2.090  -1.350  0.00  0.00    +0.170 HD
ATOM      8  C   LIG    1        0.664   0.405  -0.196  0.00  0.00    +0.141 A 
ATOM      9  O   LIG    1       -1.103   2.984  -1.843  0.00  0.00    -0.267 OA
ATOM     10  C   LIG    1       -3.309   1.532  -0.779  0.00  0.00    +0.015 A 
ATOM     11  C   LIG    1       -4.312   0.738  -0.230  0.00  0.00    +0.001 A 
ATOM     12  N   LIG    1       -0.264  -0.349   0.299  0.00  0.00    -0.229 NA
ATOM     13  C   LIG    1       -3.974  -0.409   0.491  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   8  14
ATOM     14  C   LIG    1        2.099   0.049  -0.025  0.00  0.00    +0.018 A 
ATOM     15  C   LIG    1        2.441  -1.304   0.124  0.00  0.00    +0.014 A 
ATOM     16  C   LIG    1        3.776  -1.678   0.287  0.00  0.00    +0.039 A 
ATOM     17  C   LIG    1        4.763  -0.699   0.310  0.00  0.00    +0.123 A 
ATOM     18  F   LIG    1        6.044  -1.057   0.468  0.00  0.00    -0.205 F 
ATOM     19  C   LIG    1        4.440   0.647   0.178  0.00  0.00    +0.039 A 
ATOM     20  C   LIG    1        3.105   1.027   0.014  0.00  0.00    +0.014 A 
ENDBRANCH   8  14
TORSDOF 1