REMARK  Name = BDB061222
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  F   LIG    1        2.854   2.161   0.254  0.00  0.00    -0.205 F 
ATOM      2  C   LIG    1        2.169   1.012   0.184  0.00  0.00    +0.125 A 
ATOM      3  C   LIG    1        0.781   1.054   0.076  0.00  0.00    +0.066 A 
ATOM      4  C   LIG    1        0.062  -0.144   0.003  0.00  0.00    +0.070 A 
ATOM      5  C   LIG    1        0.753  -1.368   0.041  0.00  0.00    +0.028 A 
ATOM      6  C   LIG    1        2.146  -1.391   0.151  0.00  0.00    +0.005 A 
ATOM      7  C   LIG    1        2.857  -0.195   0.223  0.00  0.00    +0.038 A 
ENDROOT
BRANCH   4   8
ATOM      8  N   LIG    1       -1.352  -0.142  -0.109  0.00  0.00    -0.220 N 
ATOM      9  N   LIG    1       -2.067  -1.293  -0.180  0.00  0.00    -0.061 NA
ATOM     10  N   LIG    1       -3.353  -0.987  -0.278  0.00  0.00    -0.138 NA
ATOM     11  C   LIG    1       -3.463   0.369  -0.268  0.00  0.00    +0.156 A 
ATOM     12  C   LIG    1       -2.215   0.930  -0.163  0.00  0.00    +0.136 A 
ENDBRANCH   4   8
TORSDOF 1