REMARK  Name = BDB056197
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.298   1.226   0.498  0.00  0.00    +0.033 A 
ATOM      2  C   LIG    1       -2.326   0.211   0.368  0.00  0.00    +0.010 A 
ATOM      3  C   LIG    1       -2.738  -1.136   0.408  0.00  0.00    +0.048 A 
ATOM      4  C   LIG    1       -1.720  -2.214   0.321  0.00  0.00    +0.257 A 
ATOM      5  N   LIG    1       -0.414  -1.813   0.177  0.00  0.00    -0.322 N 
ATOM      6  H   LIG    1        0.270  -2.558   0.125  0.00  0.00    +0.169 HD
ATOM      7  C   LIG    1       -0.005  -0.507   0.102  0.00  0.00    +0.050 A 
ATOM      8  O   LIG    1       -2.026  -3.401   0.374  0.00  0.00    -0.267 OA
ATOM      9  C   LIG    1       -4.089  -1.480   0.521  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1       -5.049  -0.477   0.575  0.00  0.00    +0.003 A 
ATOM     11  C   LIG    1       -0.892   0.497   0.182  0.00  0.00    +0.036 A 
ATOM     12  C   LIG    1       -4.654   0.862   0.543  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   7  13
ATOM     13  C   LIG    1        1.429  -0.247  -0.096  0.00  0.00    -0.002 A 
ATOM     14  C   LIG    1        2.165   0.475   0.852  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1        3.529   0.713   0.661  0.00  0.00    +0.013 A 
ATOM     16  C   LIG    1        4.185   0.227  -0.481  0.00  0.00    +0.055 A 
ATOM     17  C   LIG    1        3.444  -0.490  -1.433  0.00  0.00    +0.013 A 
ATOM     18  C   LIG    1        2.080  -0.728  -1.239  0.00  0.00    +0.010 A 
BRANCH  16  19
ATOM     19  C   LIG    1        5.653   0.504  -0.699  0.00  0.00    +0.417 C 
ATOM     20  F   LIG    1        6.357   0.600   0.464  0.00  0.00    -0.166 F 
ATOM     21  F   LIG    1        6.277  -0.459  -1.433  0.00  0.00    -0.166 F 
ATOM     22  F   LIG    1        5.864   1.675  -1.361  0.00  0.00    -0.166 F 
ENDBRANCH  16  19
ENDBRANCH   7  13
BRANCH   1  23
ATOM     23  N   LIG    1       -2.986   2.595   0.381  0.00  0.00    -0.357 N 
ATOM     24  H   LIG    1       -2.072   2.842   0.744  0.00  0.00    +0.142 HD
ATOM     25  H   LIG    1       -3.707   3.209   0.748  0.00  0.00    +0.142 HD
ENDBRANCH   1  23
TORSDOF 3