REMARK  Name = BDB051103
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.760  -1.272   1.718  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.793  -2.415   0.925  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        1.929  -2.826   0.342  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.355  -3.180   0.739  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.548  -2.807   1.360  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.602  -1.668   2.179  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.433  -0.915   2.366  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        2.151   0.019   3.075  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        1.958  -0.436   1.950  0.00  0.00    +0.249 C 
ATOM     10  N   LIG    1        2.782  -0.169   0.880  0.00  0.00    -0.296 N 
ATOM     11  C   LIG    1        2.423   0.026  -0.522  0.00  0.00    +0.116 C 
ATOM     12  C   LIG    1        3.777   0.763  -0.679  0.00  0.00    +0.005 C 
ATOM     13  C   LIG    1        3.701   2.115  -1.394  0.00  0.00    +0.025 C 
ATOM     14  C   LIG    1        3.575   1.895  -2.901  0.00  0.00    +0.081 C 
ATOM     15  N   LIG    1        4.689   1.098  -3.412  0.00  0.00    -0.316 NA
ATOM     16  H   LIG    1        4.586   0.976  -4.419  0.00  0.00    +0.122 HD
ATOM     17  C   LIG    1        4.756  -0.217  -2.771  0.00  0.00    +0.081 C 
ATOM     18  C   LIG    1        4.917  -0.088  -1.256  0.00  0.00    +0.025 C 
ATOM     19  C   LIG    1        3.809   0.871   0.862  0.00  0.00    +0.116 C 
ENDBRANCH   1   9
BRANCH   6  20
ATOM     20  C   LIG    1       -2.888  -1.283   2.875  0.00  0.00    +0.093 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -4.036  -1.035   1.905  0.00  0.00    +0.074 A 
ATOM     22  C   LIG    1       -4.156   0.272   1.206  0.00  0.00    +0.011 A 
ATOM     23  C   LIG    1       -5.212   0.417   0.308  0.00  0.00    +0.050 A 
ATOM     24  C   LIG    1       -5.394   1.615  -0.395  0.00  0.00    +0.014 A 
ATOM     25  C   LIG    1       -4.512   2.675  -0.196  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1       -3.456   2.539   0.703  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1       -6.144  -0.704   0.107  0.00  0.00    +0.272 A 
ATOM     28  O   LIG    1       -7.085  -0.621  -0.675  0.00  0.00    -0.266 OA
ATOM     29  N   LIG    1       -5.897  -1.835   0.843  0.00  0.00    -0.242 N 
ATOM     30  H   LIG    1       -6.533  -2.617   0.719  0.00  0.00    +0.192 HD
ATOM     31  C   LIG    1       -3.275   1.342   1.405  0.00  0.00    +0.010 A 
ATOM     32  N   LIG    1       -4.872  -2.015   1.717  0.00  0.00    -0.175 NA
ENDBRANCH  20  21
ENDBRANCH   6  20
TORSDOF 3