REMARK  Name = BDB025317
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.617  -2.376  -1.187  0.00  0.00    +0.118 A 
ATOM      2  N   LIG    1       -0.548  -1.667  -0.787  0.00  0.00    -0.215 NA
ATOM      3  C   LIG    1       -0.839  -0.408  -0.398  0.00  0.00    +0.145 A 
ATOM      4  C   LIG    1       -2.093   0.184  -0.355  0.00  0.00    +0.027 A 
ATOM      5  C   LIG    1       -1.918   1.511   0.140  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1       -0.551   1.695   0.387  0.00  0.00    +0.052 A 
ATOM      7  C   LIG    1       -0.051   2.907   0.895  0.00  0.00    +0.026 A 
ATOM      8  C   LIG    1       -0.957   3.941   1.151  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -2.317   3.779   0.912  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -2.809   2.572   0.408  0.00  0.00    +0.010 A 
ATOM     11  C   LIG    1       -3.186  -0.596  -0.765  0.00  0.00    +0.015 A 
ATOM     12  N   LIG    1        0.082   0.515   0.037  0.00  0.00    -0.313 N 
ATOM     13  C   LIG    1       -2.925  -1.901  -1.184  0.00  0.00    +0.044 A 
ENDROOT
BRANCH  12  14
ATOM     14  C   LIG    1        1.512   0.240   0.154  0.00  0.00    +0.176 C 
ATOM     15  C   LIG    1        2.103  -0.256  -1.162  0.00  0.00    +0.242 C 
ATOM     16  O   LIG    1        1.871   0.269  -2.250  0.00  0.00    -0.273 OA
ATOM     17  N   LIG    1        3.029  -1.270  -1.077  0.00  0.00    -0.255 N 
ATOM     18  H   LIG    1        3.420  -1.571  -1.960  0.00  0.00    +0.158 HD
ATOM     19  C   LIG    1        3.740  -1.640   0.035  0.00  0.00    +0.219 C 
ATOM     20  O   LIG    1        4.749  -2.333  -0.059  0.00  0.00    -0.275 OA
ATOM     21  C   LIG    1        3.282  -1.058   1.349  0.00  0.00    +0.099 C 
ATOM     22  C   LIG    1        1.801  -0.722   1.311  0.00  0.00    +0.044 C 
ENDBRANCH  12  14
BRANCH   1  23
ATOM     23  N   LIG    1       -1.365  -3.689  -1.594  0.00  0.00    -0.343 N 
ATOM     24  H   LIG    1       -0.358  -3.820  -1.575  0.00  0.00    +0.144 HD
ATOM     25  H   LIG    1       -1.749  -3.866  -2.515  0.00  0.00    +0.144 HD
ENDBRANCH   1  23
TORSDOF 2