REMARK  Name = BDB025485
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -4.610  -1.306   0.254  0.00  0.00    -0.297 NA
ATOM      2  C   LIG    1       -3.397  -2.104  -0.040  0.00  0.00    +0.142 C 
ATOM      3  C   LIG    1       -2.147  -1.382   0.367  0.00  0.00    +0.083 A 
ATOM      4  N   LIG    1       -0.932  -1.736  -0.043  0.00  0.00    -0.166 NA
ATOM      5  N   LIG    1       -0.081  -0.806   0.507  0.00  0.00    -0.185 N 
ATOM      6  C   LIG    1       -0.785   0.023   1.406  0.00  0.00    +0.126 A 
ATOM      7  C   LIG    1        1.263  -0.805   0.051  0.00  0.00    +0.257 C 
ATOM      8  O   LIG    1        1.665  -1.743  -0.635  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1       -2.115  -0.294   1.258  0.00  0.00    +0.018 A 
ATOM     10  C   LIG    1       -3.353   0.271   1.854  0.00  0.00    +0.056 C 
ATOM     11  C   LIG    1       -4.568  -0.643   1.570  0.00  0.00    +0.089 C 
ENDROOT
BRANCH   7  12
ATOM     12  C   LIG    1        2.101   0.420   0.389  0.00  0.00    +0.113 C 
ATOM     13  C   LIG    1        3.593   0.151   0.213  0.00  0.00    -0.012 A 
ATOM     14  C   LIG    1        4.297   0.674  -0.888  0.00  0.00    +0.031 A 
ATOM     15  C   LIG    1        5.678   0.442  -0.987  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1        6.341  -0.349  -0.049  0.00  0.00    +0.040 A 
ATOM     17  C   LIG    1        5.628  -0.893   1.009  0.00  0.00    +0.124 A 
ATOM     18  F   LIG    1        6.261  -1.649   1.915  0.00  0.00    -0.205 F 
ATOM     19  N   LIG    1        3.693   1.545  -1.807  0.00  0.00    -0.344 N 
ATOM     20  H   LIG    1        4.134   1.491  -2.723  0.00  0.00    +0.146 HD
ATOM     21  C   LIG    1        2.241   1.500  -1.869  0.00  0.00    +0.102 C 
ATOM     22  C   LIG    1        4.268  -0.650   1.152  0.00  0.00    +0.044 A 
ATOM     23  C   LIG    1        1.662   1.617  -0.466  0.00  0.00    +0.036 C 
ENDBRANCH   7  12
BRANCH   6  24
ATOM     24  N   LIG    1       -0.247   0.954   2.240  0.00  0.00    -0.343 N 
ATOM     25  H   LIG    1       -0.903   1.450   2.845  0.00  0.00    +0.144 HD
ATOM     26  H   LIG    1        0.545   0.672   2.818  0.00  0.00    +0.144 HD
ENDBRANCH   6  24
BRANCH   1  28
ATOM     27  C   LIG    1       -4.141   0.540  -1.466  0.00  0.00    +0.020 C 
ATOM     28  C   LIG    1       -5.090  -0.485  -0.857  0.00  0.00    +0.081 C 
ENDBRANCH   1  28
TORSDOF 3