REMARK  Name = BDB000098
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.561  -0.652   0.064  0.00  0.00    +0.139 C 
ATOM      2  N   LIG    1       -1.428   0.229  -0.022  0.00  0.00    -0.267 N 
ATOM      3  C   LIG    1       -0.090  -0.191   0.018  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1        0.778   0.895  -0.087  0.00  0.00    +0.048 A 
ATOM      5  C   LIG    1        2.153   0.763  -0.074  0.00  0.00    +0.014 A 
ATOM      6  C   LIG    1        2.664  -0.529   0.051  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        1.800  -1.637   0.158  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1       -0.042   2.100  -0.203  0.00  0.00    +0.250 C 
ATOM      9  O   LIG    1        0.348   3.239  -0.314  0.00  0.00    -0.282 OA
ATOM     10  C   LIG    1        0.408  -1.474   0.143  0.00  0.00    +0.024 A 
ATOM     11  C   LIG    1       -1.512   1.607  -0.155  0.00  0.00    +0.291 C 
ATOM     12  O   LIG    1       -2.492   2.317  -0.224  0.00  0.00    -0.266 OA
ENDROOT
TORSDOF 0