REMARK  Name = BDB002570
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.366  -2.202  -1.436  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1        1.380  -1.183  -0.750  0.00  0.00    +0.280 C 
ATOM      3  N   LIG    1        0.226  -0.574  -0.313  0.00  0.00    -0.305 N 
ATOM      4  H   LIG    1        0.319   0.212   0.321  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        2.595  -0.521  -0.324  0.00  0.00    +0.191 A 
ATOM      6  O   LIG    1        2.511   0.599   0.463  0.00  0.00    -0.444 OA
ATOM      7  C   LIG    1        3.784   1.009   0.713  0.00  0.00    +0.171 A 
ATOM      8 BR   LIG    1        4.229   2.531   1.763  0.00  0.00    -0.008 Br
ATOM      9  C   LIG    1        4.688   0.171   0.103  0.00  0.00    +0.058 A 
ATOM     10  C   LIG    1        3.923  -0.816  -0.565  0.00  0.00    +0.056 A 
ENDBRANCH   2   5
BRANCH   3  11
ATOM     11  C   LIG    1       -1.068  -1.153  -0.557  0.00  0.00    +0.140 C 
BRANCH  11  12
ATOM     12  C   LIG    1       -2.162  -0.225  -0.110  0.00  0.00    -0.027 A 
ATOM     13  C   LIG    1       -2.595   0.815  -0.937  0.00  0.00    +0.025 A 
ATOM     14  C   LIG    1       -3.587   1.665  -0.472  0.00  0.00    +0.111 A 
ATOM     15  N   LIG    1       -4.160   1.553   0.744  0.00  0.00    -0.263 NA
ATOM     16  C   LIG    1       -3.722   0.548   1.532  0.00  0.00    +0.111 A 
ATOM     17  C   LIG    1       -2.736  -0.351   1.157  0.00  0.00    +0.025 A 
ENDBRANCH  11  12
ENDBRANCH   3  11
TORSDOF 3