REMARK  Name = BDB054183
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.291   0.756   1.330  0.00  0.00    +0.285 C 
ENDROOT
BRANCH   1   3
ATOM      2  O   LIG    1       -1.326   1.817   2.878  0.00  0.00    -0.247 OA
ATOM      3  C   LIG    1       -0.309   1.865   2.205  0.00  0.00    +0.346 C 
BRANCH   3   4
ATOM      4  O   LIG    1        0.449   2.984   2.242  0.00  0.00    -0.478 OA
ATOM      5  H   LIG    1       -0.026   3.566   2.874  0.00  0.00    +0.295 HD
ENDBRANCH   3   4
ENDBRANCH   1   3
BRANCH   1   6
ATOM      6  O   LIG    1       -0.435  -0.473   1.285  0.00  0.00    -0.477 OA
BRANCH   6   7
ATOM      7  C   LIG    1       -1.667  -0.578   0.711  0.00  0.00    +0.122 A 
ATOM      8  C   LIG    1       -2.479   0.466   0.266  0.00  0.00    +0.048 A 
ATOM      9  C   LIG    1       -3.725   0.191  -0.309  0.00  0.00    +0.042 A 
ATOM     10  C   LIG    1       -4.155  -1.124  -0.433  0.00  0.00    +0.124 A 
ATOM     11  F   LIG    1       -5.348  -1.381  -0.985  0.00  0.00    -0.205 F 
ATOM     12  C   LIG    1       -3.364  -2.174   0.010  0.00  0.00    +0.042 A 
ATOM     13  C   LIG    1       -2.122  -1.897   0.583  0.00  0.00    +0.048 A 
ENDBRANCH   6   7
ENDBRANCH   1   6
BRANCH   1  14
ATOM     14  C   LIG    1        0.726   1.252  -0.064  0.00  0.00    +0.091 C 
BRANCH  14  15
ATOM     15  C   LIG    1        1.821   0.397  -0.665  0.00  0.00    -0.043 A 
ATOM     16  C   LIG    1        3.169   0.717  -0.448  0.00  0.00    +0.004 A 
ATOM     17  C   LIG    1        4.179  -0.079  -0.989  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        3.853  -1.202  -1.747  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        2.517  -1.531  -1.964  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        1.504  -0.736  -1.425  0.00  0.00    +0.004 A 
ENDBRANCH  14  15
ENDBRANCH   1  14
TORSDOF 6