REMARK  Name = BDB000803
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.450  -1.058   0.359  0.00  0.00    -0.294 N 
ATOM      2  H   LIG    1        0.368  -1.990   0.754  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   6
ATOM      3  F   LIG    1       -2.453   2.813   0.435  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -2.269   1.504   0.214  0.00  0.00    +0.125 A 
ATOM      5  C   LIG    1       -1.009   0.948   0.422  0.00  0.00    +0.061 A 
ATOM      6  C   LIG    1       -0.794  -0.417   0.213  0.00  0.00    +0.035 A 
ATOM      7  C   LIG    1       -1.885  -1.193  -0.223  0.00  0.00    +0.023 A 
ATOM      8  C   LIG    1       -3.148  -0.629  -0.432  0.00  0.00    +0.005 A 
ATOM      9  C   LIG    1       -3.340   0.730  -0.212  0.00  0.00    +0.038 A 
ENDBRANCH   1   6
BRANCH   1  10
ATOM     10  C   LIG    1        1.706  -0.555   0.409  0.00  0.00    +0.163 A 
ATOM     11  S   LIG    1        2.247   0.864  -0.425  0.00  0.00    -0.045 S 
ATOM     12  C   LIG    1        3.812   0.609   0.164  0.00  0.00    +0.076 A 
ATOM     13 BR   LIG    1        5.295   1.746  -0.197  0.00  0.00    -0.041 Br
ATOM     14  C   LIG    1        3.868  -0.529   0.922  0.00  0.00    +0.136 A 
ATOM     15  N   LIG    1        2.665  -1.202   1.044  0.00  0.00    -0.232 NA
ENDBRANCH   1  10
TORSDOF 2