REMARK  Name = BDB064063
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.459   0.348  -0.621  0.00  0.00    -0.218 N 
ATOM      2  C   LIG    1       -1.954  -0.722   0.082  0.00  0.00    +0.268 C 
ATOM      3  O   LIG    1       -2.508  -1.746   0.440  0.00  0.00    -0.268 OA
ATOM      4  C   LIG    1       -0.531  -0.358   0.356  0.00  0.00    +0.098 C 
ATOM      5  C   LIG    1        0.339  -1.122   1.024  0.00  0.00    +0.038 C 
ATOM      6  N   LIG    1       -0.338   0.884  -0.167  0.00  0.00    -0.265 N 
ATOM      7  H   LIG    1        0.510   1.429  -0.103  0.00  0.00    +0.157 HD
ATOM      8  C   LIG    1       -1.506   1.342  -0.749  0.00  0.00    +0.313 C 
ATOM      9  O   LIG    1       -1.639   2.439  -1.266  0.00  0.00    -0.252 OA
ENDROOT
BRANCH   5  10
ATOM     10  C   LIG    1        1.698  -0.801   1.313  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1        2.723  -0.337   0.432  0.00  0.00    +0.007 A 
ATOM     12  C   LIG    1        3.870  -0.156   1.209  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1        5.080   0.310   0.679  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1        5.124   0.591  -0.689  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1        4.005   0.404  -1.495  0.00  0.00    +0.001 A 
ATOM     16  N   LIG    1        3.554  -0.525   2.497  0.00  0.00    -0.360 N 
ATOM     17  H   LIG    1        4.202  -0.506   3.273  0.00  0.00    +0.165 HD
ATOM     18  C   LIG    1        2.803  -0.063  -0.950  0.00  0.00    +0.010 A 
ATOM     19  C   LIG    1        2.249  -0.935   2.567  0.00  0.00    +0.091 A 
ENDBRANCH   5  10
BRANCH   1  21
ATOM     20  C   LIG    1       -4.262  -0.646  -1.996  0.00  0.00    +0.028 C 
ATOM     21  C   LIG    1       -3.839   0.494  -1.070  0.00  0.00    +0.080 C 
ATOM     22  C   LIG    1       -4.796   0.622   0.114  0.00  0.00    +0.028 C 
ENDBRANCH   1  21
TORSDOF 2