REMARK  Name = BDB054181
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.371  -1.597   0.977  0.00  0.00    +0.285 C 
ENDROOT
BRANCH   1   3
ATOM      2  O   LIG    1       -0.262  -3.792   2.031  0.00  0.00    -0.247 OA
ATOM      3  C   LIG    1       -0.917  -2.952   1.429  0.00  0.00    +0.346 C 
BRANCH   3   4
ATOM      4  O   LIG    1       -2.222  -3.144   1.115  0.00  0.00    -0.478 OA
ATOM      5  H   LIG    1       -2.567  -2.365   0.626  0.00  0.00    +0.295 HD
ENDBRANCH   3   4
ENDBRANCH   1   3
BRANCH   1   6
ATOM      6  O   LIG    1       -1.450  -0.838   0.390  0.00  0.00    -0.474 OA
BRANCH   6   7
ATOM      7  C   LIG    1       -1.236  -0.478  -0.915  0.00  0.00    +0.157 A 
ATOM      8  C   LIG    1       -0.896  -1.384  -1.921  0.00  0.00    +0.165 A 
ATOM      9  F   LIG    1       -0.742  -2.685  -1.635  0.00  0.00    -0.202 F 
ATOM     10  C   LIG    1       -0.732  -0.963  -3.237  0.00  0.00    +0.042 A 
ATOM     11  C   LIG    1       -0.926   0.381  -3.558  0.00  0.00    +0.003 A 
ATOM     12  C   LIG    1       -1.292   1.289  -2.563  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1       -1.457   0.858  -1.244  0.00  0.00    +0.048 A 
ENDBRANCH   6   7
ENDBRANCH   1   6
BRANCH   1  14
ATOM     14  C   LIG    1        0.139  -0.851   2.219  0.00  0.00    +0.091 C 
BRANCH  14  15
ATOM     15  C   LIG    1        0.898   0.408   1.866  0.00  0.00    -0.043 A 
ATOM     16  C   LIG    1        2.200   0.332   1.353  0.00  0.00    +0.004 A 
ATOM     17  C   LIG    1        2.893   1.493   1.008  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        2.293   2.740   1.175  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        1.001   2.827   1.688  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        0.305   1.667   2.033  0.00  0.00    +0.004 A 
ENDBRANCH  14  15
ENDBRANCH   1  14
TORSDOF 6