REMARK  Name = BDB012640
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.164  -1.693   0.144  0.00  0.00    +0.143 A 
ATOM      2  C   LIG    1        4.778  -0.472   0.408  0.00  0.00    +0.130 A 
ATOM      3  C   LIG    1        3.986   0.665   0.498  0.00  0.00    +0.089 A 
ATOM      4  N   LIG    1        4.891   1.652   0.767  0.00  0.00    -0.257 N 
ATOM      5  H   LIG    1        4.738   2.642   0.914  0.00  0.00    +0.191 HD
ATOM      6  N   LIG    1        6.145   1.177   0.832  0.00  0.00    -0.067 NA
ATOM      7  C   LIG    1        2.603   0.642   0.333  0.00  0.00    +0.059 A 
ATOM      8  C   LIG    1        2.064  -0.620   0.069  0.00  0.00    +0.093 A 
ATOM      9  N   LIG    1        6.088  -0.132   0.614  0.00  0.00    -0.128 NA
ATOM     10  N   LIG    1        2.816  -1.753  -0.024  0.00  0.00    -0.251 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        0.626  -0.794  -0.123  0.00  0.00    +0.107 A 
ATOM     12  N   LIG    1       -0.048  -1.976   0.117  0.00  0.00    -0.234 NA
ATOM     13  C   LIG    1       -1.304  -1.740  -0.181  0.00  0.00    +0.200 A 
ATOM     14  N   LIG    1       -1.479  -0.456  -0.605  0.00  0.00    -0.336 N 
ATOM     15  C   LIG    1       -0.260   0.167  -0.575  0.00  0.00    +0.117 A 
BRANCH  14  16
ATOM     16  C   LIG    1       -2.735   0.127  -1.044  0.00  0.00    +0.126 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -3.482   0.748   0.097  0.00  0.00    +0.009 C 
ATOM     18  C   LIG    1       -4.430  -0.070   0.938  0.00  0.00    +0.005 C 
ATOM     19  C   LIG    1       -4.970   0.970  -0.006  0.00  0.00    +0.005 C 
ENDBRANCH  16  17
ENDBRANCH  14  16
ENDBRANCH   8  11
TORSDOF 3