REMARK  Name = BDB054142
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -3.267   1.086  -0.080  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1       -2.366   0.256  -0.046  0.00  0.00    +0.259 A 
ATOM      3  C   LIG    1       -0.942   0.639  -0.030  0.00  0.00    +0.065 A 
ATOM      4  C   LIG    1        0.012  -0.390   0.009  0.00  0.00    +0.089 A 
ATOM      5  C   LIG    1        1.372  -0.048   0.025  0.00  0.00    +0.081 A 
ATOM      6  C   LIG    1        1.743   1.313   0.001  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        0.779   2.322  -0.037  0.00  0.00    +0.001 A 
ATOM      8  N   LIG    1       -0.369  -1.744   0.032  0.00  0.00    -0.237 NA
ATOM      9  C   LIG    1       -1.626  -2.025   0.016  0.00  0.00    +0.199 A 
ATOM     10  C   LIG    1       -0.570   1.986  -0.053  0.00  0.00    +0.015 A 
ATOM     11  N   LIG    1       -2.617  -1.090  -0.021  0.00  0.00    -0.313 N 
ATOM     12  H   LIG    1       -3.589  -1.366  -0.032  0.00  0.00    +0.170 HD
ENDROOT
BRANCH   5  13
ATOM     13  C   LIG    1        2.427  -1.123   0.066  0.00  0.00    +0.419 C 
ATOM     14  F   LIG    1        2.395  -1.958  -1.010  0.00  0.00    -0.166 F 
ATOM     15  F   LIG    1        3.696  -0.611   0.076  0.00  0.00    -0.166 F 
ATOM     16  F   LIG    1        2.357  -1.910   1.175  0.00  0.00    -0.166 F 
ENDBRANCH   5  13
TORSDOF 1