REMARK  Name = BDB027682
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.367   0.966   0.518  0.00  0.00    +0.135 A 
ATOM      2  C   LIG    1       -0.178   2.234   0.781  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1       -1.396   2.500   0.154  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1       -1.946   3.749   0.397  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1       -1.412   4.719   1.187  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -0.247   4.425   1.788  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1       -2.020   1.617  -0.640  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1       -1.429   0.426  -0.820  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        0.402   3.215   1.621  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1       -0.260   0.072  -0.267  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1       -2.103  -0.559  -1.685  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1       -1.515  -1.798  -1.981  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1       -2.186  -2.694  -2.799  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1       -3.396  -2.452  -3.342  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1       -3.956  -1.260  -3.056  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1       -3.362  -0.302  -2.250  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1        1.617   0.622   1.093  0.00  0.00    -0.297 N 
ATOM     18  H   LIG    1        2.311   1.330   0.859  0.00  0.00    +0.154 HD
BRANCH  17  21
ATOM     19  F   LIG    1        4.356   0.392   1.071  0.00  0.00    -0.204 F 
ATOM     20  C   LIG    1        3.633  -0.737   1.161  0.00  0.00    +0.144 A 
ATOM     21  C   LIG    1        2.232  -0.653   1.139  0.00  0.00    +0.068 A 
ATOM     22  C   LIG    1        1.508  -1.843   1.274  0.00  0.00    +0.026 A 
ATOM     23  C   LIG    1        2.166  -3.075   1.375  0.00  0.00    +0.002 A 
ATOM     24  C   LIG    1        3.560  -3.132   1.364  0.00  0.00    +0.003 A 
ATOM     25  C   LIG    1        4.298  -1.956   1.261  0.00  0.00    +0.040 A 
ENDBRANCH  17  21
ENDBRANCH   1  17
TORSDOF 3