REMARK  Name = BDB005547
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.082  -2.227   0.841  0.00  0.00    +0.129 C 
ATOM      2  N   LIG    1       -1.262  -1.052  -0.038  0.00  0.00    -0.332 N 
ATOM      3  C   LIG    1       -0.342   0.023   0.022  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1        1.123  -0.221  -0.097  0.00  0.00    +0.020 A 
ATOM      5  C   LIG    1        2.015   0.819   0.205  0.00  0.00    +0.051 A 
ATOM      6  N   LIG    1        1.519   2.091   0.495  0.00  0.00    -0.322 N 
ATOM      7  H   LIG    1        2.149   2.862   0.665  0.00  0.00    +0.169 HD
ATOM      8  C   LIG    1        0.197   2.417   0.400  0.00  0.00    +0.254 A 
ATOM      9  O   LIG    1       -0.181   3.575   0.552  0.00  0.00    -0.268 OA
ATOM     10  C   LIG    1        3.401   0.634   0.151  0.00  0.00    +0.026 A 
ATOM     11  C   LIG    1        3.918  -0.589  -0.269  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1        3.053  -1.609  -0.655  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        1.669  -1.418  -0.584  0.00  0.00    +0.012 A 
ATOM     14  C   LIG    1       -0.755   1.304   0.139  0.00  0.00    +0.039 A 
ATOM     15  C   LIG    1       -2.205   1.673   0.018  0.00  0.00    +0.044 C 
ATOM     16  C   LIG    1       -2.949   0.619  -0.797  0.00  0.00    +0.024 C 
ATOM     17  C   LIG    1       -2.708  -0.761  -0.205  0.00  0.00    +0.105 C 
ENDROOT
TORSDOF 0