REMARK  Name = BDB000769
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  F   LIG    1        4.683   0.526   0.096  0.00  0.00    -0.205 F 
ATOM      2  C   LIG    1        3.385   0.197   0.064  0.00  0.00    +0.124 A 
ATOM      3  C   LIG    1        3.015  -1.139   0.112  0.00  0.00    +0.040 A 
ATOM      4  C   LIG    1        1.660  -1.477   0.077  0.00  0.00    +0.026 A 
ATOM      5  C   LIG    1        0.663  -0.488  -0.011  0.00  0.00    +0.033 A 
ATOM      6  C   LIG    1        1.069   0.852  -0.053  0.00  0.00    +0.026 A 
ATOM      7  C   LIG    1        2.425   1.195  -0.019  0.00  0.00    +0.040 A 
ENDROOT
BRANCH   5   8
ATOM      8  N   LIG    1       -0.680  -0.908  -0.002  0.00  0.00    -0.294 N 
ATOM      9  H   LIG    1       -0.833  -1.745  -0.554  0.00  0.00    +0.154 HD
BRANCH   8  10
ATOM     10  C   LIG    1       -1.817  -0.229   0.279  0.00  0.00    +0.162 A 
ATOM     11  S   LIG    1       -1.953   1.060   1.426  0.00  0.00    -0.061 S 
ATOM     12  C   LIG    1       -3.633   1.163   1.127  0.00  0.00    +0.068 A 
ATOM     13  C   LIG    1       -3.995   0.204   0.211  0.00  0.00    +0.120 A 
ATOM     14  N   LIG    1       -2.967  -0.592  -0.252  0.00  0.00    -0.233 NA
ENDBRANCH   8  10
ENDBRANCH   5   8
TORSDOF 2