REMARK  Name = BDB020234
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.933  -0.156  -0.404  0.00  0.00    +0.111 C 
ATOM      2  C   LIG    1       -1.504   1.255  -0.233  0.00  0.00    +0.227 C 
ATOM      3  O   LIG    1       -0.899   2.208   0.251  0.00  0.00    -0.275 OA
ATOM      4  N   LIG    1       -2.812   1.407  -0.637  0.00  0.00    -0.256 N 
ATOM      5  H   LIG    1       -3.181   2.340  -0.509  0.00  0.00    +0.157 HD
ATOM      6  C   LIG    1       -3.764   0.420  -0.633  0.00  0.00    +0.219 C 
ATOM      7  O   LIG    1       -4.961   0.692  -0.606  0.00  0.00    -0.275 OA
ATOM      8  C   LIG    1       -3.260  -1.003  -0.680  0.00  0.00    +0.097 C 
ATOM      9  C   LIG    1       -1.973  -1.153   0.119  0.00  0.00    +0.027 C 
ENDROOT
BRANCH   1  14
ATOM     10  C   LIG    1        3.959   0.849  -0.744  0.00  0.00    +0.152 C 
ATOM     11  N   LIG    1        2.831   0.299  -0.009  0.00  0.00    -0.318 N 
ATOM     12  C   LIG    1        1.564   0.323  -0.592  0.00  0.00    +0.255 A 
ATOM     13  O   LIG    1        1.334   0.752  -1.722  0.00  0.00    -0.267 OA
ATOM     14  C   LIG    1        0.435  -0.246   0.234  0.00  0.00    +0.029 A 
ATOM     15  C   LIG    1        0.725  -0.783   1.433  0.00  0.00    +0.011 A 
ATOM     16  C   LIG    1        2.070  -0.796   1.946  0.00  0.00    +0.018 A 
ATOM     17  C   LIG    1        3.064  -0.260   1.232  0.00  0.00    +0.089 A 
ENDBRANCH   1  14
TORSDOF 1