REMARK  Name = BDB002573
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.264   0.347   1.293  0.00  0.00    +0.194 A 
ATOM      2  O   LIG    1       -0.074   0.180   1.562  0.00  0.00    -0.451 OA
ATOM      3  C   LIG    1       -0.747   1.245   1.046  0.00  0.00    +0.143 A 
ATOM      4  C   LIG    1        0.140   2.112   0.449  0.00  0.00    +0.049 A 
ATOM      5  C   LIG    1        1.425   1.538   0.605  0.00  0.00    +0.055 A 
ENDROOT
BRANCH   1   7
ATOM      6  O   LIG    1        1.751  -1.705   2.338  0.00  0.00    -0.262 OA
ATOM      7  C   LIG    1        2.163  -0.699   1.755  0.00  0.00    +0.314 C 
ATOM      8  N   LIG    1        3.571  -0.650   1.575  0.00  0.00    -0.200 N 
ATOM      9  N   LIG    1        4.191   0.401   0.955  0.00  0.00    -0.171 NA
ATOM     10  C   LIG    1        5.490   0.088   0.979  0.00  0.00    +0.150 A 
ATOM     11  C   LIG    1        5.721  -1.139   1.601  0.00  0.00    +0.056 A 
ATOM     12 BR   LIG    1        7.386  -1.942   1.845  0.00  0.00    -0.047 Br
ATOM     13  C   LIG    1        4.494  -1.603   1.979  0.00  0.00    +0.133 A 
ENDBRANCH   1   7
BRANCH   3  14
ATOM     14  C   LIG    1       -2.221   1.249   1.228  0.00  0.00    +0.303 C 
BRANCH  14  15
ATOM     15  O   LIG    1       -2.845   1.554  -0.022  0.00  0.00    -0.484 OA
BRANCH  15  16
ATOM     16  C   LIG    1       -3.137   0.525  -0.874  0.00  0.00    +0.121 A 
ATOM     17  C   LIG    1       -3.945   0.883  -1.960  0.00  0.00    +0.048 A 
ATOM     18  C   LIG    1       -4.316  -0.065  -2.913  0.00  0.00    +0.042 A 
ATOM     19  C   LIG    1       -3.871  -1.373  -2.781  0.00  0.00    +0.124 A 
ATOM     20  F   LIG    1       -4.222  -2.288  -3.694  0.00  0.00    -0.205 F 
ATOM     21  C   LIG    1       -3.061  -1.745  -1.714  0.00  0.00    +0.042 A 
ATOM     22  C   LIG    1       -2.690  -0.794  -0.759  0.00  0.00    +0.048 A 
ENDBRANCH  15  16
ENDBRANCH  14  15
ENDBRANCH   3  14
TORSDOF 4