REMARK  Name = BDB046780
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.348   2.336   0.151  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1       -1.210   1.121   0.080  0.00  0.00    +0.259 A 
ATOM      3  C   LIG    1        0.117   0.486   0.026  0.00  0.00    +0.068 A 
ATOM      4  C   LIG    1        0.157  -0.904  -0.054  0.00  0.00    +0.096 A 
ATOM      5  C   LIG    1        1.420  -1.475  -0.103  0.00  0.00    +0.139 A 
ATOM      6  N   LIG    1        2.582  -0.773  -0.079  0.00  0.00    -0.261 NA
ATOM      7  C   LIG    1        2.485   0.572  -0.001  0.00  0.00    +0.111 A 
ATOM      8  N   LIG    1       -1.002  -1.702  -0.084  0.00  0.00    -0.236 NA
ATOM      9  C   LIG    1       -2.138  -1.094  -0.034  0.00  0.00    +0.199 A 
ATOM     10  C   LIG    1        1.283   1.250   0.054  0.00  0.00    +0.035 A 
ATOM     11  N   LIG    1       -2.278   0.262   0.045  0.00  0.00    -0.313 N 
ATOM     12  H   LIG    1       -3.194   0.685   0.082  0.00  0.00    +0.170 HD
ENDROOT
TORSDOF 0