REMARK  Name = BDB002065
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.068  -0.509  -1.916  0.00  0.00    -0.252 OA
ATOM      2  C   LIG    1       -0.228  -0.253  -0.752  0.00  0.00    +0.307 C 
ATOM      3  N   LIG    1       -1.547   0.013  -0.361  0.00  0.00    -0.281 N 
ATOM      4  C   LIG    1       -2.559  -0.078  -1.416  0.00  0.00    +0.114 C 
ATOM      5  C   LIG    1       -3.949  -0.386  -0.855  0.00  0.00    +0.046 C 
ATOM      6  C   LIG    1       -4.250   0.411   0.377  0.00  0.00    -0.028 C 
ATOM      7  C   LIG    1       -3.279   1.040   1.055  0.00  0.00    -0.012 C 
ATOM      8  C   LIG    1       -1.823   0.994   0.693  0.00  0.00    +0.136 C 
ATOM      9  N   LIG    1        0.672  -0.233   0.293  0.00  0.00    -0.269 N 
ATOM     10  H   LIG    1        0.271  -0.470   1.188  0.00  0.00    +0.156 HD
ENDROOT
BRANCH   9  11
ATOM     11  C   LIG    1        2.078  -0.291   0.203  0.00  0.00    +0.036 A 
ATOM     12  C   LIG    1        2.787  -0.052  -0.977  0.00  0.00    +0.044 A 
ATOM     13  C   LIG    1        4.187  -0.108  -0.989  0.00  0.00    +0.061 A 
ATOM     14 CL   LIG    1        4.994   0.202  -2.487  0.00  0.00    -0.082 Cl
ATOM     15  C   LIG    1        4.886  -0.398   0.186  0.00  0.00    +0.059 A 
ATOM     16 CL   LIG    1        6.611  -0.482   0.248  0.00  0.00    -0.082 Cl
ATOM     17  C   LIG    1        4.182  -0.626   1.370  0.00  0.00    +0.023 A 
ATOM     18  C   LIG    1        2.785  -0.568   1.378  0.00  0.00    +0.025 A 
ENDBRANCH   9  11
TORSDOF 1