REMARK  Name = BDB016141
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.109  -2.622   0.956  0.00  0.00    +0.028 C 
ATOM      2  C   LIG    1       -2.466  -1.151   0.718  0.00  0.00    +0.076 C 
ATOM      3  N   LIG    1       -1.330  -0.506   0.082  0.00  0.00    -0.339 N 
ATOM      4  H   LIG    1       -0.437  -0.907   0.365  0.00  0.00    +0.146 HD
ATOM      5  C   LIG    1       -1.253   0.901   0.040  0.00  0.00    +0.058 A 
ATOM      6  C   LIG    1       -2.369   1.772   0.056  0.00  0.00    +0.055 A 
ATOM      7  C   LIG    1       -2.162   3.167   0.022  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1       -0.890   3.719  -0.083  0.00  0.00    +0.003 A 
ATOM      9  C   LIG    1        0.209   2.881  -0.163  0.00  0.00    +0.012 A 
ATOM     10  N   LIG    1       -3.733   1.414   0.112  0.00  0.00    -0.284 N 
ATOM     11  H   LIG    1       -4.399   2.174   0.190  0.00  0.00    +0.155 HD
ATOM     12  C   LIG    1       -4.387   0.230   0.025  0.00  0.00    +0.219 C 
ATOM     13  O   LIG    1       -5.620   0.240   0.097  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1        0.045   1.487  -0.113  0.00  0.00    +0.021 A 
ATOM     15  C   LIG    1       -3.655  -1.051  -0.211  0.00  0.00    +0.118 C 
ENDROOT
BRANCH  14  16
ATOM     16  C   LIG    1        1.263   0.672  -0.210  0.00  0.00    +0.049 A 
ATOM     17  N   LIG    1        2.277   0.740   0.719  0.00  0.00    -0.354 N 
ATOM     18  H   LIG    1        2.272   1.340   1.531  0.00  0.00    +0.166 HD
ATOM     19  C   LIG    1        3.288  -0.138   0.403  0.00  0.00    +0.047 A 
ATOM     20  C   LIG    1        2.916  -0.784  -0.774  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        3.785  -1.745  -1.325  0.00  0.00    +0.010 A 
ATOM     22  C   LIG    1        4.994  -2.025  -0.677  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        5.340  -1.364   0.499  0.00  0.00    +0.002 A 
ATOM     24  C   LIG    1        4.493  -0.406   1.064  0.00  0.00    +0.026 A 
ATOM     25  C   LIG    1        1.647  -0.266  -1.151  0.00  0.00    +0.036 A 
ENDBRANCH  14  16
TORSDOF 1