REMARK  Name = BDB060650
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.690   0.315   1.060  0.00  0.00    +0.247 C 
ATOM      2  N   LIG    1       -2.298  -0.996   0.866  0.00  0.00    -0.290 N 
ATOM      3  C   LIG    1       -1.371  -1.516  -0.144  0.00  0.00    +0.107 C 
ATOM      4  C   LIG    1       -1.567  -3.039  -0.084  0.00  0.00    +0.029 C 
ATOM      5  C   LIG    1       -2.078  -3.295   1.329  0.00  0.00    +0.021 C 
ATOM      6  C   LIG    1       -2.927  -2.067   1.616  0.00  0.00    +0.109 C 
ATOM      7  O   LIG    1       -3.515   0.665   1.898  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   3   8
ATOM      8  C   LIG    1        0.070  -1.099   0.084  0.00  0.00    -0.023 A 
ATOM      9  C   LIG    1        0.861  -0.746  -1.023  0.00  0.00    +0.055 A 
ATOM     10  C   LIG    1        2.181  -0.333  -0.851  0.00  0.00    +0.162 A 
ATOM     11  O   LIG    1        2.877  -0.011  -1.988  0.00  0.00    -0.485 OA
ATOM     12  C   LIG    1        4.283   0.077  -1.732  0.00  0.00    +0.270 C 
ATOM     13  C   LIG    1        4.550   0.865  -0.460  0.00  0.00    +0.270 C 
ATOM     14  O   LIG    1        4.003   0.188   0.678  0.00  0.00    -0.485 OA
ATOM     15  C   LIG    1        2.727  -0.249   0.431  0.00  0.00    +0.162 A 
ATOM     16  C   LIG    1        1.967  -0.623   1.536  0.00  0.00    +0.050 A 
ATOM     17  C   LIG    1        0.646  -1.045   1.363  0.00  0.00    +0.009 A 
ENDBRANCH   3   8
BRANCH   1  21
ATOM     18  C   LIG    1       -0.815   3.310  -1.323  0.00  0.00    +0.052 A 
ATOM     19  C   LIG    1       -1.835   2.520  -1.873  0.00  0.00    +0.019 A 
ATOM     20  C   LIG    1       -2.463   1.545  -1.095  0.00  0.00    +0.014 A 
ATOM     21  C   LIG    1       -2.059   1.358   0.230  0.00  0.00    +0.037 A 
ATOM     22  C   LIG    1       -1.064   2.161   0.795  0.00  0.00    +0.014 A 
ATOM     23  C   LIG    1       -0.436   3.133   0.013  0.00  0.00    +0.019 A 
BRANCH  18  25
ATOM     24  N   LIG    1        0.370   5.099  -2.782  0.00  0.00    -0.191 NA
ATOM     25  C   LIG    1       -0.161   4.300  -2.128  0.00  0.00    +0.099 C 
ENDBRANCH  18  25
ENDBRANCH   1  21
TORSDOF 3