REMARK  Name = BDB058153
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.499   0.308   0.389  0.00  0.00    +0.141 A 
ATOM      2  N   LIG    1        2.075   1.320   1.123  0.00  0.00    -0.306 N 
ATOM      3  H   LIG    1        1.514   1.990   1.629  0.00  0.00    +0.170 HD
ATOM      4  C   LIG    1        3.428   1.442   1.328  0.00  0.00    +0.262 A 
ATOM      5  O   LIG    1        3.880   2.335   2.033  0.00  0.00    -0.267 OA
ATOM      6  C   LIG    1        4.262   0.434   0.659  0.00  0.00    +0.100 A 
ATOM      7  C   LIG    1        3.602  -0.558  -0.072  0.00  0.00    +0.081 A 
ATOM      8  C   LIG    1        4.361  -1.539  -0.719  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        5.756  -1.532  -0.638  0.00  0.00    +0.005 A 
ATOM     10  C   LIG    1        6.402  -0.538   0.095  0.00  0.00    +0.039 A 
ATOM     11  C   LIG    1        5.652   0.442   0.742  0.00  0.00    +0.138 A 
ATOM     12  F   LIG    1        6.308   1.383   1.436  0.00  0.00    -0.205 F 
ATOM     13  N   LIG    1        2.203  -0.614  -0.187  0.00  0.00    -0.229 NA
ENDROOT
BRANCH   1  17
ATOM     14  C   LIG    1       -2.811   0.208   0.118  0.00  0.00    -0.017 A 
ATOM     15  C   LIG    1       -2.133   1.427   0.283  0.00  0.00    +0.007 A 
ATOM     16  C   LIG    1       -0.737   1.479   0.369  0.00  0.00    +0.012 A 
ATOM     17  C   LIG    1        0.014   0.302   0.298  0.00  0.00    +0.017 A 
ATOM     18  C   LIG    1       -0.643  -0.918   0.116  0.00  0.00    +0.012 A 
ATOM     19  C   LIG    1       -2.038  -0.964   0.030  0.00  0.00    +0.007 A 
BRANCH  14  21
ATOM     20  C   LIG    1       -4.774  -0.361  -1.358  0.00  0.00    +0.046 C 
ATOM     21  C   LIG    1       -4.335   0.150   0.020  0.00  0.00    +0.085 C 
ATOM     22  C   LIG    1       -4.928  -0.720   1.136  0.00  0.00    +0.046 C 
BRANCH  21  23
ATOM     23  O   LIG    1       -4.883   1.465   0.178  0.00  0.00    -0.385 OA
ATOM     24  H   LIG    1       -5.849   1.394   0.101  0.00  0.00    +0.211 HD
ENDBRANCH  21  23
ENDBRANCH  14  21
ENDBRANCH   1  17
TORSDOF 3