REMARK  Name = BDB047610
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        3.928  -1.585  -0.091  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        3.083  -0.715  -0.123  0.00  0.00    +0.251 C 
ATOM      3  C   LIG    1        1.641  -0.924   0.007  0.00  0.00    +0.049 A 
ATOM      4  C   LIG    1        0.921  -2.097   0.198  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1       -0.471  -1.998   0.305  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1       -1.076  -0.741   0.205  0.00  0.00    -0.043 A 
ATOM      7  C   LIG    1       -2.533  -0.411   0.333  0.00  0.00    +0.036 C 
ATOM      8  C   LIG    1       -2.575   1.002  -0.270  0.00  0.00    +0.009 C 
ATOM      9  C   LIG    1       -1.200   1.639  -0.015  0.00  0.00    +0.036 C 
ATOM     10  C   LIG    1       -0.328   0.430   0.009  0.00  0.00    -0.031 A 
ATOM     11  C   LIG    1        1.035   0.321  -0.081  0.00  0.00    +0.053 A 
ATOM     12  C   LIG    1        2.091   1.315  -0.261  0.00  0.00    +0.252 C 
ATOM     13  O   LIG    1        1.929   2.514  -0.367  0.00  0.00    -0.270 OA
ATOM     14  N   LIG    1        3.264   0.625  -0.281  0.00  0.00    -0.248 N 
ATOM     15  H   LIG    1        4.167   1.060  -0.389  0.00  0.00    +0.158 HD
ENDROOT
TORSDOF 0