REMARK  Name = BDB000543
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.582  -0.603   0.361  0.00  0.00    +0.059 A 
ATOM      2  C   LIG    1        3.067  -1.784  -0.185  0.00  0.00    +0.015 A 
ATOM      3  C   LIG    1        1.796  -1.793  -0.769  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1        1.027  -0.621  -0.814  0.00  0.00    +0.026 A 
ATOM      5  C   LIG    1        1.544   0.561  -0.268  0.00  0.00    +0.012 A 
ATOM      6  C   LIG    1        2.816   0.569   0.316  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        5.654  -1.617   1.046  0.00  0.00    -0.245 OA
ATOM      8  C   LIG    1        4.934  -0.639   0.970  0.00  0.00    +0.337 C 
BRANCH   8   9
ATOM      9  O   LIG    1        5.318   0.553   1.457  0.00  0.00    -0.477 OA
ATOM     10  H   LIG    1        6.214   0.383   1.817  0.00  0.00    +0.295 HD
ENDBRANCH   8   9
ENDBRANCH   1   8
BRANCH   4  11
ATOM     11  C   LIG    1       -0.324  -0.687  -1.432  0.00  0.00    +0.233 C 
ATOM     12  O   LIG    1       -0.771  -1.731  -1.893  0.00  0.00    -0.283 OA
BRANCH  11  13
ATOM     13  C   LIG    1       -1.193   0.548  -1.471  0.00  0.00    +0.233 C 
ATOM     14  O   LIG    1       -0.814   1.503  -2.139  0.00  0.00    -0.283 OA
BRANCH  13  15
ATOM     15  C   LIG    1       -2.448   0.595  -0.676  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1       -2.884  -0.487   0.098  0.00  0.00    +0.012 A 
ATOM     17  C   LIG    1       -4.063  -0.386   0.841  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1       -4.809   0.792   0.817  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -4.381   1.873   0.047  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -3.204   1.776  -0.698  0.00  0.00    +0.012 A 
ENDBRANCH  13  15
ENDBRANCH  11  13
ENDBRANCH   4  11
TORSDOF 5