REMARK  Name = BDB001752
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.818   0.599  -0.034  0.00  0.00    +0.017 A 
ATOM      2  C   LIG    1       -2.026   1.597   0.555  0.00  0.00    +0.015 A 
ATOM      3  C   LIG    1       -0.634   1.515   0.508  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1       -0.039   0.425  -0.119  0.00  0.00    +0.132 A 
ATOM      5  C   LIG    1       -0.806  -0.565  -0.732  0.00  0.00    +0.047 A 
ATOM      6  C   LIG    1       -2.200  -0.481  -0.682  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1       -5.168  -0.364  -0.518  0.00  0.00    +0.091 C 
ATOM      8  C   LIG    1       -4.304   0.733   0.046  0.00  0.00    +0.160 C 
ATOM      9  O   LIG    1       -4.802   1.731   0.564  0.00  0.00    -0.292 OA
ENDBRANCH   1   8
BRANCH   4  10
ATOM     10  O   LIG    1        1.355   0.381  -0.193  0.00  0.00    -0.420 OA
BRANCH  10  11
ATOM     11  C   LIG    1        1.941  -0.544   0.667  0.00  0.00    +0.380 C 
ATOM     12  O   LIG    1        1.340  -1.288   1.435  0.00  0.00    -0.241 OA
BRANCH  11  13
ATOM     13  C   LIG    1        3.378  -0.503   0.521  0.00  0.00    +0.213 A 
ATOM     14  O   LIG    1        3.957   0.358  -0.374  0.00  0.00    -0.442 OA
ATOM     15  C   LIG    1        5.302   0.181  -0.297  0.00  0.00    +0.171 A 
ATOM     16 BR   LIG    1        6.570   1.141  -1.340  0.00  0.00    -0.008 Br
ATOM     17  C   LIG    1        5.606  -0.783   0.635  0.00  0.00    +0.058 A 
ATOM     18  C   LIG    1        4.368  -1.225   1.163  0.00  0.00    +0.058 A 
ENDBRANCH  11  13
ENDBRANCH  10  11
ENDBRANCH   4  10
TORSDOF 4