REMARK  Name = BDB027695
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.440  -0.152   1.067  0.00  0.00    +0.135 A 
ATOM      2  C   LIG    1        0.022   0.060   2.377  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.389   0.317   2.491  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        1.865   0.519   3.777  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        1.126   0.495   4.917  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -0.189   0.263   4.771  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.215   0.372   1.435  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.677   0.177   0.222  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1       -0.782   0.042   3.542  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.380  -0.084   0.004  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.568   0.248  -0.950  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        2.085   0.049  -2.253  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        2.959   0.127  -3.326  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        4.276   0.385  -3.202  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        4.737   0.575  -1.950  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        3.939   0.518  -0.817  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.813  -0.462   0.863  0.00  0.00    -0.299 N 
ATOM     18  H   LIG    1       -2.053  -1.270   1.429  0.00  0.00    +0.154 HD
BRANCH  17  22
ATOM     19  F   LIG    1       -2.692   1.269  -3.556  0.00  0.00    -0.205 F 
ATOM     20  C   LIG    1       -3.009   0.434  -2.557  0.00  0.00    +0.125 A 
ATOM     21  C   LIG    1       -2.232   0.423  -1.402  0.00  0.00    +0.061 A 
ATOM     22  C   LIG    1       -2.533  -0.453  -0.354  0.00  0.00    +0.035 A 
ATOM     23  C   LIG    1       -3.673  -1.266  -0.480  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1       -4.451  -1.249  -1.643  0.00  0.00    +0.005 A 
ATOM     25  C   LIG    1       -4.112  -0.399  -2.690  0.00  0.00    +0.038 A 
ENDBRANCH  17  22
ENDBRANCH   1  17
TORSDOF 3