REMARK  Name = BDB062118
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.888  -2.499  -0.189  0.00  0.00    -0.287 OA
ATOM      2  C   LIG    1        1.619  -1.305  -0.161  0.00  0.00    +0.188 C 
ATOM      3  C   LIG    1        0.232  -0.824  -0.024  0.00  0.00    +0.036 A 
ATOM      4  C   LIG    1       -0.060   0.544   0.007  0.00  0.00    +0.075 A 
ATOM      5  C   LIG    1       -1.404   0.934   0.139  0.00  0.00    +0.128 A 
ATOM      6  C   LIG    1       -2.424  -0.019   0.237  0.00  0.00    +0.046 A 
ATOM      7  C   LIG    1       -2.117  -1.376   0.205  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1        1.048   1.536  -0.100  0.00  0.00    +0.209 C 
ATOM      9  O   LIG    1        0.855   2.745  -0.080  0.00  0.00    -0.286 OA
ATOM     10  C   LIG    1        2.429   0.995  -0.236  0.00  0.00    +0.092 C 
ATOM     11 CL   LIG    1        3.727   2.130  -0.362  0.00  0.00    -0.079 Cl
ATOM     12  C   LIG    1       -0.792  -1.780   0.075  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1        2.692  -0.311  -0.264  0.00  0.00    +0.075 C 
ENDROOT
BRANCH   5  14
ATOM     14  O   LIG    1       -1.751   2.254   0.175  0.00  0.00    -0.506 OA
ATOM     15  H   LIG    1       -2.711   2.358   0.269  0.00  0.00    +0.292 HD
ENDBRANCH   5  14
TORSDOF 1