REMARK  Name = BDB009116
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.807   0.075  -1.953  0.00  0.00    +0.018 A 
ATOM      2  C   LIG    1        0.678   1.067  -2.936  0.00  0.00    +0.131 A 
ATOM      3  F   LIG    1        1.712   1.873  -3.226  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.512   1.258  -3.635  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.617   0.457  -3.358  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.541  -0.534  -2.371  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.323  -0.725  -1.693  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  11
ATOM      8  C   LIG    1        4.476  -0.540   0.195  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1        3.268  -0.455   0.890  0.00  0.00    +0.013 A 
ATOM     10  C   LIG    1        2.076  -0.247   0.187  0.00  0.00    +0.009 A 
ATOM     11  C   LIG    1        2.067  -0.136  -1.216  0.00  0.00    -0.015 A 
ATOM     12  C   LIG    1        3.295  -0.251  -1.894  0.00  0.00    +0.009 A 
ATOM     13  C   LIG    1        4.490  -0.459  -1.198  0.00  0.00    +0.013 A 
BRANCH   8  16
ATOM     14  C   LIG    1        7.269  -0.305   2.759  0.00  0.00    +0.132 C 
ATOM     15  N   LIG    1        6.098   0.045   1.976  0.00  0.00    -0.304 N 
ATOM     16  C   LIG    1        5.748  -0.787   0.913  0.00  0.00    +0.246 C 
ATOM     17  O   LIG    1        6.432  -1.738   0.542  0.00  0.00    -0.270 OA
ATOM     18  C   LIG    1        5.567   1.386   2.183  0.00  0.00    +0.132 C 
ENDBRANCH   8  16
ENDBRANCH   1  11
BRANCH   6  19
ATOM     19  C   LIG    1       -2.736  -1.416  -2.079  0.00  0.00    +0.092 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -3.091  -1.486  -0.595  0.00  0.00    +0.069 A 
ATOM     21  C   LIG    1       -3.958  -0.427   0.010  0.00  0.00    -0.016 A 
ATOM     22  C   LIG    1       -4.476   0.716  -0.818  0.00  0.00    +0.037 C 
ATOM     23  C   LIG    1       -5.081   1.849   0.017  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1       -5.951   1.304   1.141  0.00  0.00    +0.005 C 
ATOM     25  C   LIG    1       -5.141   0.393   2.066  0.00  0.00    +0.041 C 
ATOM     26  C   LIG    1       -4.248  -0.557   1.316  0.00  0.00    +0.023 A 
ATOM     27  C   LIG    1       -3.688  -1.690   2.095  0.00  0.00    +0.268 A 
ATOM     28  O   LIG    1       -3.910  -1.824   3.293  0.00  0.00    -0.266 OA
ATOM     29  N   LIG    1       -2.909  -2.570   1.394  0.00  0.00    -0.243 N 
ATOM     30  H   LIG    1       -2.521  -3.355   1.906  0.00  0.00    +0.192 HD
ATOM     31  N   LIG    1       -2.605  -2.491   0.072  0.00  0.00    -0.175 NA
ENDBRANCH  19  20
ENDBRANCH   6  19
TORSDOF 4