REMARK  Name = BDB051559
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.959   2.776  -1.434  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1        1.416   1.799  -0.927  0.00  0.00    +0.258 A 
ATOM      3  C   LIG    1        2.226   0.685  -0.323  0.00  0.00    +0.049 A 
ATOM      4  C   LIG    1        1.588  -0.431   0.256  0.00  0.00    +0.016 A 
ATOM      5  C   LIG    1        2.347  -1.461   0.815  0.00  0.00    +0.011 A 
ATOM      6  C   LIG    1        3.741  -1.381   0.797  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        4.377  -0.276   0.224  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        0.150  -0.463   0.248  0.00  0.00    +0.115 A 
ATOM      9  N   LIG    1       -0.690  -1.420   0.740  0.00  0.00    -0.226 NA
ATOM     10  C   LIG    1       -1.901  -0.963   0.476  0.00  0.00    +0.140 A 
ATOM     11  N   LIG    1       -1.864   0.275  -0.179  0.00  0.00    -0.284 N 
ATOM     12  C   LIG    1       -3.004   0.973  -0.568  0.00  0.00    +0.114 A 
ATOM     13  C   LIG    1       -4.209   0.440  -0.308  0.00  0.00    +0.058 A 
ATOM     14 CL   LIG    1       -5.660   1.241  -0.758  0.00  0.00    -0.082 Cl
ATOM     15  C   LIG    1       -4.294  -0.844   0.370  0.00  0.00    +0.025 A 
ATOM     16  C   LIG    1       -3.186  -1.514   0.745  0.00  0.00    +0.048 A 
ATOM     17  C   LIG    1       -0.534   0.583  -0.318  0.00  0.00    +0.146 A 
ATOM     18  C   LIG    1        3.623   0.758  -0.337  0.00  0.00    +0.014 A 
ATOM     19  N   LIG    1        0.033   1.694  -0.896  0.00  0.00    -0.306 N 
ATOM     20  H   LIG    1       -0.506   2.446  -1.304  0.00  0.00    +0.170 HD
ENDROOT
TORSDOF 0