REMARK  Name = BDB051560
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.957   3.058  -0.651  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1        1.417   1.981  -0.417  0.00  0.00    +0.258 A 
ATOM      3  C   LIG    1        2.229   0.753  -0.112  0.00  0.00    +0.049 A 
ATOM      4  C   LIG    1        1.594  -0.477   0.154  0.00  0.00    +0.016 A 
ATOM      5  C   LIG    1        2.355  -1.613   0.437  0.00  0.00    +0.011 A 
ATOM      6  C   LIG    1        3.748  -1.524   0.456  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        4.382  -0.307   0.192  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        0.156  -0.513   0.123  0.00  0.00    +0.115 A 
ATOM      9  N   LIG    1       -0.682  -1.568   0.343  0.00  0.00    -0.226 NA
ATOM     10  C   LIG    1       -1.893  -1.064   0.193  0.00  0.00    +0.140 A 
ATOM     11  N   LIG    1       -1.859   0.301  -0.121  0.00  0.00    -0.284 N 
ATOM     12  C   LIG    1       -3.001   1.070  -0.330  0.00  0.00    +0.110 A 
ATOM     13  C   LIG    1       -4.209   0.489  -0.230  0.00  0.00    +0.035 A 
ATOM     14 BR   LIG    1       -5.796   1.425  -0.489  0.00  0.00    -0.049 Br
ATOM     15  C   LIG    1       -4.285  -0.930   0.096  0.00  0.00    +0.020 A 
ATOM     16  C   LIG    1       -3.176  -1.670   0.297  0.00  0.00    +0.048 A 
ATOM     17  C   LIG    1       -0.530   0.640  -0.162  0.00  0.00    +0.146 A 
ATOM     18  C   LIG    1        3.626   0.833  -0.092  0.00  0.00    +0.014 A 
ATOM     19  N   LIG    1        0.034   1.865  -0.429  0.00  0.00    -0.306 N 
ATOM     20  H   LIG    1       -0.507   2.694  -0.635  0.00  0.00    +0.170 HD
ENDROOT
TORSDOF 0