REMARK  Name = BDB051675
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -4.884  -1.967   0.881  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1       -3.746  -1.593   0.626  0.00  0.00    +0.244 C 
ATOM      3  C   LIG    1       -3.435  -0.176   0.291  0.00  0.00    +0.042 A 
ATOM      4  C   LIG    1       -2.097   0.266   0.219  0.00  0.00    -0.010 A 
ATOM      5  C   LIG    1       -1.839   1.574  -0.227  0.00  0.00    -0.040 A 
ATOM      6  C   LIG    1       -0.426   2.025  -0.467  0.00  0.00    +0.054 C 
ATOM      7  C   LIG    1        0.572   1.232   0.362  0.00  0.00    +0.113 C 
ATOM      8  N   LIG    1        0.366  -0.217   0.258  0.00  0.00    -0.289 N 
ATOM      9  C   LIG    1        1.448  -1.063   0.544  0.00  0.00    +0.249 C 
ATOM     10  O   LIG    1        1.351  -2.117   1.166  0.00  0.00    -0.270 OA
ATOM     11  C   LIG    1       -2.905   2.427  -0.548  0.00  0.00    +0.004 A 
ATOM     12  C   LIG    1       -4.225   1.993  -0.422  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -0.978  -0.683   0.652  0.00  0.00    +0.125 C 
ATOM     14  C   LIG    1       -1.371  -2.088   0.132  0.00  0.00    +0.131 C 
ATOM     15  C   LIG    1       -4.491   0.690  -0.011  0.00  0.00    +0.013 A 
ATOM     16  N   LIG    1       -2.690  -2.468   0.611  0.00  0.00    -0.309 N 
ATOM     17  H   LIG    1       -2.930  -3.446   0.723  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   9  18
ATOM     18  C   LIG    1        2.799  -0.672   0.087  0.00  0.00    +0.055 A 
ATOM     19  C   LIG    1        3.107  -0.454  -1.261  0.00  0.00    +0.053 A 
ATOM     20 CL   LIG    1        1.948  -0.638  -2.528  0.00  0.00    -0.083 Cl
ATOM     21  C   LIG    1        4.410  -0.095  -1.620  0.00  0.00    +0.021 A 
ATOM     22  C   LIG    1        5.402   0.031  -0.644  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        5.099  -0.212   0.696  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        3.802  -0.570   1.062  0.00  0.00    +0.014 A 
ENDBRANCH   9  18
TORSDOF 1