REMARK  Name = BDB050059
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.573  -0.869  -0.523  0.00  0.00    +0.093 A 
ATOM      2  N   LIG    1        1.643  -0.154   0.009  0.00  0.00    -0.210 N 
ATOM      3  C   LIG    1        2.808  -0.825  -0.347  0.00  0.00    +0.155 A 
ATOM      4  C   LIG    1        4.043  -0.286   0.083  0.00  0.00    +0.052 A 
ATOM      5  C   LIG    1        4.050   0.837   0.808  0.00  0.00    +0.064 A 
ATOM      6  C   LIG    1        2.736   1.437   1.109  0.00  0.00    +0.232 A 
ATOM      7  F   LIG    1        2.764   2.560   1.836  0.00  0.00    -0.182 F 
ATOM      8  N   LIG    1        2.560  -1.898  -1.056  0.00  0.00    -0.234 NA
ATOM      9  N   LIG    1        1.576   0.998   0.749  0.00  0.00    -0.134 NA
ATOM     10  C   LIG    1        1.197  -1.933  -1.169  0.00  0.00    +0.141 A 
ENDROOT
BRANCH   1  13
ATOM     11  C   LIG    1       -2.749   0.807   0.339  0.00  0.00    +0.015 A 
ATOM     12  C   LIG    1       -1.370   0.558   0.270  0.00  0.00    +0.021 A 
ATOM     13  C   LIG    1       -0.870  -0.558  -0.418  0.00  0.00    +0.003 A 
ATOM     14  C   LIG    1       -1.812  -1.409  -1.030  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1       -3.189  -1.161  -0.961  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -3.660  -0.049  -0.274  0.00  0.00    +0.011 A 
BRANCH  11  18
ATOM     17  O   LIG    1       -4.421   2.264   1.170  0.00  0.00    -0.296 OA
ATOM     18  C   LIG    1       -3.229   1.995   1.075  0.00  0.00    +0.258 C 
ENDBRANCH  11  18
ENDBRANCH   1  13
TORSDOF 2