REMARK  Name = BDB054146
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.243  -0.789  -0.499  0.00  0.00    +0.086 C 
ATOM      2  C   LIG    1       -1.845  -0.313  -0.230  0.00  0.00    +0.107 A 
ATOM      3  N   LIG    1       -1.722   0.948   0.281  0.00  0.00    -0.310 N 
ATOM      4  H   LIG    1       -2.533   1.522   0.464  0.00  0.00    +0.170 HD
ATOM      5  C   LIG    1       -0.513   1.529   0.582  0.00  0.00    +0.262 A 
ATOM      6  O   LIG    1       -0.457   2.663   1.038  0.00  0.00    -0.267 OA
ATOM      7  C   LIG    1        0.671   0.698   0.317  0.00  0.00    +0.100 A 
ATOM      8  C   LIG    1        0.452  -0.581  -0.206  0.00  0.00    +0.081 A 
ATOM      9  C   LIG    1        1.553  -1.401  -0.472  0.00  0.00    +0.029 A 
ATOM     10  C   LIG    1        2.853  -0.955  -0.220  0.00  0.00    +0.005 A 
ATOM     11  C   LIG    1        3.058   0.321   0.301  0.00  0.00    +0.039 A 
ATOM     12  C   LIG    1        1.966   1.144   0.568  0.00  0.00    +0.138 A 
ATOM     13  F   LIG    1        2.202   2.364   1.069  0.00  0.00    -0.205 F 
ATOM     14  N   LIG    1       -0.834  -1.079  -0.478  0.00  0.00    -0.234 NA
ENDROOT
TORSDOF 0