REMARK  Name = BDB062565
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.287  -2.373  -0.451  0.00  0.00    -0.144 OA
ATOM      2  N   LIG    1        0.540  -1.154  -0.265  0.00  0.00    -0.042 N 
ATOM      3  N   LIG    1        1.928  -0.667  -0.216  0.00  0.00    -0.204 N 
ATOM      4  C   LIG    1        1.887   0.715   0.002  0.00  0.00    +0.159 A 
ATOM      5  C   LIG    1        3.132   1.395   0.084  0.00  0.00    +0.068 A 
ATOM      6  C   LIG    1        4.278   0.697  -0.048  0.00  0.00    +0.046 A 
ATOM      7  C   LIG    1        4.279  -0.745  -0.274  0.00  0.00    +0.040 A 
ATOM      8 CL   LIG    1        5.805   1.493   0.047  0.00  0.00    -0.083 Cl
ATOM      9  N   LIG    1        0.621   1.130   0.091  0.00  0.00    -0.205 NA
ATOM     10  C   LIG    1        3.105  -1.396  -0.353  0.00  0.00    +0.117 A 
ATOM     11  C   LIG    1       -0.198  -0.029  -0.074  0.00  0.00    +0.202 A 
ENDROOT
BRANCH  11  12
ATOM     12  C   LIG    1       -1.653   0.044  -0.034  0.00  0.00    +0.023 A 
ATOM     13  C   LIG    1       -2.260   1.294   0.174  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1       -3.652   1.425   0.222  0.00  0.00    +0.016 A 
ATOM     15  C   LIG    1       -4.454   0.301   0.061  0.00  0.00    +0.018 A 
ATOM     16 BR   LIG    1       -6.335   0.469   0.124  0.00  0.00    -0.050 Br
ATOM     17  C   LIG    1       -3.876  -0.948  -0.146  0.00  0.00    +0.016 A 
ATOM     18  C   LIG    1       -2.482  -1.075  -0.193  0.00  0.00    +0.013 A 
ENDBRANCH  11  12
TORSDOF 1