REMARK  Name = BDB002937
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.782   1.008   0.750  0.00  0.00    +0.064 C 
ATOM      2  C   LIG    1       -1.846   0.181  -0.124  0.00  0.00    +0.175 C 
ATOM      3  N   LIG    1       -1.095  -0.733   0.787  0.00  0.00    -0.135 N 
ATOM      4  O   LIG    1       -1.621  -1.688   1.716  0.00  0.00    -0.166 OA
ATOM      5  C   LIG    1        0.295  -0.545   0.582  0.00  0.00    +0.108 A 
ATOM      6  C   LIG    1        0.438   0.480  -0.355  0.00  0.00    +0.099 A 
ATOM      7  C   LIG    1        1.702   0.835  -0.786  0.00  0.00    +0.062 A 
ATOM      8  C   LIG    1        2.794   0.136  -0.250  0.00  0.00    +0.128 A 
ATOM      9  C   LIG    1        2.621  -0.902   0.704  0.00  0.00    +0.035 A 
ATOM     10  C   LIG    1        1.342  -1.255   1.132  0.00  0.00    +0.033 A 
ATOM     11  N   LIG    1       -0.798   1.064  -0.741  0.00  0.00    -0.189 N 
ATOM     12  O   LIG    1       -1.006   1.507  -2.080  0.00  0.00    -0.082 OA
ATOM     13  C   LIG    1       -2.592  -0.727  -1.102  0.00  0.00    +0.064 C 
ENDROOT
BRANCH   8  14
ATOM     14  N   LIG    1        4.152   0.482  -0.682  0.00  0.00    +0.056 N 
ATOM     15  O   LIG    1        4.321   1.529  -1.323  0.00  0.00    -0.126 OA
ATOM     16  O   LIG    1        5.069  -0.294  -0.368  0.00  0.00    -0.126 OA
ENDBRANCH   8  14
TORSDOF 1