REMARK  Name = BDB051351
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.517   0.909   0.347  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        0.500   0.577   1.249  0.00  0.00    +0.040 A 
ATOM      3  C   LIG    1        1.767   0.272   0.759  0.00  0.00    +0.067 A 
ATOM      4  N   LIG    1        2.788  -0.075   1.658  0.00  0.00    -0.319 N 
ATOM      5  H   LIG    1        2.615  -0.097   2.654  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1        4.072  -0.396   1.275  0.00  0.00    +0.273 A 
ATOM      7  C   LIG    1        4.313  -0.351  -0.144  0.00  0.00    +0.112 A 
ATOM      8  N   LIG    1        3.325  -0.009  -1.042  0.00  0.00    -0.310 N 
ATOM      9  C   LIG    1        3.846  -0.052  -2.314  0.00  0.00    +0.092 A 
ATOM     10  C   LIG    1        5.172  -0.423  -2.227  0.00  0.00    +0.020 A 
ATOM     11  C   LIG    1        5.467  -0.612  -0.858  0.00  0.00    +0.033 A 
ATOM     12  O   LIG    1        4.916  -0.693   2.114  0.00  0.00    -0.266 OA
ATOM     13  C   LIG    1        2.016   0.314  -0.623  0.00  0.00    +0.070 A 
ATOM     14  C   LIG    1        1.006   0.670  -1.522  0.00  0.00    +0.029 A 
ATOM     15  C   LIG    1       -0.265   0.976  -1.029  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  17
ATOM     16  O   LIG    1       -1.928   2.220   1.640  0.00  0.00    -0.270 OA
ATOM     17  C   LIG    1       -1.847   1.256   0.884  0.00  0.00    +0.247 C 
ATOM     18  N   LIG    1       -2.922   0.464   0.531  0.00  0.00    -0.298 N 
ATOM     19  C   LIG    1       -4.243   0.728   1.080  0.00  0.00    +0.108 C 
ATOM     20  C   LIG    1       -4.992  -0.588   0.925  0.00  0.00    +0.020 C 
ATOM     21  C   LIG    1       -4.354  -1.201  -0.314  0.00  0.00    +0.020 C 
ATOM     22  C   LIG    1       -2.890  -0.813  -0.170  0.00  0.00    +0.108 C 
ENDBRANCH   1  17
TORSDOF 1