REMARK  Name = BDB059067
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.107   3.532   2.606  0.00  0.00    +0.065 C 
ATOM      2  C   LIG    1       -1.089   2.193   1.923  0.00  0.00    +0.041 A 
ATOM      3  N   LIG    1       -0.071   1.964   1.067  0.00  0.00    -0.232 NA
ATOM      4  C   LIG    1       -0.091   0.765   0.439  0.00  0.00    +0.165 A 
ATOM      5  C   LIG    1       -1.045  -0.233   0.625  0.00  0.00    +0.056 A 
ATOM      6  C   LIG    1       -0.678  -1.260  -0.283  0.00  0.00    +0.076 A 
ATOM      7  N   LIG    1        0.463  -0.972  -0.917  0.00  0.00    -0.169 NA
ATOM      8  C   LIG    1       -2.053   0.034   1.566  0.00  0.00    +0.073 A 
ATOM      9  N   LIG    1        0.813   0.279  -0.503  0.00  0.00    -0.214 N 
ATOM     10  C   LIG    1       -2.087   1.273   2.205  0.00  0.00    +0.038 A 
ENDROOT
BRANCH   9  11
ATOM     11  C   LIG    1        1.987   0.892  -1.043  0.00  0.00    +0.068 A 
ATOM     12  C   LIG    1        2.404   2.175  -0.655  0.00  0.00    +0.030 A 
ATOM     13  C   LIG    1        3.559   2.737  -1.208  0.00  0.00    +0.040 A 
ATOM     14  C   LIG    1        4.297   2.024  -2.144  0.00  0.00    +0.124 A 
ATOM     15  F   LIG    1        5.402   2.569  -2.669  0.00  0.00    -0.205 F 
ATOM     16  C   LIG    1        3.904   0.755  -2.543  0.00  0.00    +0.040 A 
ATOM     17  C   LIG    1        2.751   0.187  -1.994  0.00  0.00    +0.030 A 
ENDBRANCH   9  11
BRANCH   6  18
ATOM     18  C   LIG    1       -1.387  -2.554  -0.599  0.00  0.00    +0.034 C 
ATOM     19  C   LIG    1       -1.622  -2.728  -2.103  0.00  0.00    +0.014 C 
ATOM     20  C   LIG    1       -0.630  -3.758  -0.035  0.00  0.00    +0.014 C 
ENDBRANCH   6  18
BRANCH   8  21
ATOM     21  C   LIG    1       -3.076  -0.953   1.922  0.00  0.00    +0.338 C 
ATOM     22  O   LIG    1       -4.269  -0.738   1.823  0.00  0.00    -0.245 OA
BRANCH  21  23
ATOM     23  O   LIG    1       -2.542  -2.082   2.431  0.00  0.00    -0.477 OA
ATOM     24  H   LIG    1       -1.573  -2.063   2.556  0.00  0.00    +0.295 HD
ENDBRANCH  21  23
ENDBRANCH   8  21
TORSDOF 4