REMARK  Name = BDB062567
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.378  -1.910  -1.534  0.00  0.00    -0.144 OA
ATOM      2  N   LIG    1        0.594  -0.936  -0.766  0.00  0.00    -0.042 N 
ATOM      3  N   LIG    1        1.966  -0.555  -0.395  0.00  0.00    -0.203 N 
ATOM      4  C   LIG    1        1.888   0.552   0.460  0.00  0.00    +0.172 A 
ATOM      5  C   LIG    1        3.126   1.079   0.937  0.00  0.00    +0.062 A 
ATOM      6  C   LIG    1        4.285   0.501   0.553  0.00  0.00    +0.020 A 
ATOM      7  C   LIG    1        4.316  -0.652  -0.339  0.00  0.00    +0.021 A 
ATOM      8 BR   LIG    1        3.081   2.553   2.077  0.00  0.00    -0.046 Br
ATOM      9  N   LIG    1        0.605   0.887   0.648  0.00  0.00    -0.204 NA
ATOM     10  C   LIG    1        3.157  -1.154  -0.793  0.00  0.00    +0.116 A 
ATOM     11  C   LIG    1       -0.177  -0.034  -0.109  0.00  0.00    +0.202 A 
ENDROOT
BRANCH  11  12
ATOM     12  C   LIG    1       -1.632   0.034  -0.137  0.00  0.00    +0.023 A 
ATOM     13  C   LIG    1       -2.275   1.039   0.606  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1       -3.669   1.153   0.617  0.00  0.00    +0.016 A 
ATOM     15  C   LIG    1       -4.438   0.258  -0.119  0.00  0.00    +0.018 A 
ATOM     16 BR   LIG    1       -6.321   0.405  -0.110  0.00  0.00    -0.050 Br
ATOM     17  C   LIG    1       -3.824  -0.745  -0.864  0.00  0.00    +0.016 A 
ATOM     18  C   LIG    1       -2.428  -0.856  -0.872  0.00  0.00    +0.013 A 
ENDBRANCH  11  12
TORSDOF 1