REMARK  Name = BDB016292
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.509   0.989   2.267  0.00  0.00    +0.028 C 
ATOM      2  C   LIG    1       -2.410   1.373   0.793  0.00  0.00    +0.076 C 
ATOM      3  N   LIG    1       -1.320   0.693   0.118  0.00  0.00    -0.339 N 
ATOM      4  H   LIG    1       -0.413   1.061   0.399  0.00  0.00    +0.146 HD
ATOM      5  C   LIG    1       -1.275  -0.687  -0.122  0.00  0.00    +0.057 A 
ATOM      6  C   LIG    1       -2.395  -1.551  -0.146  0.00  0.00    +0.055 A 
ATOM      7  C   LIG    1       -2.208  -2.929  -0.386  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1       -0.956  -3.466  -0.658  0.00  0.00    +0.003 A 
ATOM      9  C   LIG    1        0.142  -2.626  -0.703  0.00  0.00    +0.010 A 
ATOM     10  N   LIG    1       -3.745  -1.209   0.067  0.00  0.00    -0.284 N 
ATOM     11  H   LIG    1       -4.405  -1.976   0.125  0.00  0.00    +0.155 HD
ATOM     12  C   LIG    1       -4.394  -0.027   0.181  0.00  0.00    +0.219 C 
ATOM     13  O   LIG    1       -5.612  -0.048   0.386  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1        0.007  -1.247  -0.453  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1       -3.684   1.272  -0.006  0.00  0.00    +0.118 C 
ENDROOT
BRANCH  14  16
ATOM     16  C   LIG    1        1.232  -0.424  -0.535  0.00  0.00    -0.014 A 
ATOM     17  C   LIG    1        2.212  -0.504   0.469  0.00  0.00    +0.032 A 
ATOM     18  C   LIG    1        3.334   0.287   0.340  0.00  0.00    +0.038 A 
ATOM     19  N   LIG    1        4.414   0.372   1.203  0.00  0.00    -0.285 N 
ATOM     20  H   LIG    1        4.530  -0.147   2.060  0.00  0.00    +0.155 HD
ATOM     21  C   LIG    1        5.359   1.280   0.740  0.00  0.00    +0.222 C 
ATOM     22  C   LIG    1        4.836   1.860  -0.580  0.00  0.00    +0.133 C 
ATOM     23  O   LIG    1        6.410   1.559   1.293  0.00  0.00    -0.275 OA
ATOM     24  C   LIG    1        3.525   1.149  -0.738  0.00  0.00    -0.017 A 
ATOM     25  C   LIG    1        2.580   1.246  -1.739  0.00  0.00    +0.006 A 
ATOM     26  C   LIG    1        1.432   0.453  -1.631  0.00  0.00    +0.009 A 
ENDBRANCH  14  16
TORSDOF 1