REMARK  Name = BDB003818
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.468  -0.721  -0.043  0.00  0.00    -0.298 N 
ATOM      2  H   LIG    1       -1.151   0.134  -0.494  0.00  0.00    +0.150 HD
ATOM      3  C   LIG    1       -0.688  -1.852  -0.118  0.00  0.00    +0.245 C 
ATOM      4  O   LIG    1       -1.120  -2.971   0.134  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  11
ATOM      5  O   LIG    1       -6.145   1.891   1.244  0.00  0.00    -0.273 OA
ATOM      6  C   LIG    1       -5.487   0.866   1.067  0.00  0.00    +0.245 C 
ATOM      7  N   LIG    1       -4.882   0.662  -0.144  0.00  0.00    -0.253 N 
ATOM      8  H   LIG    1       -5.121   1.487  -0.686  0.00  0.00    +0.158 HD
ATOM      9  C   LIG    1       -3.522   0.525  -0.214  0.00  0.00    +0.242 C 
ATOM     10  O   LIG    1       -2.841   1.430  -0.705  0.00  0.00    -0.273 OA
ATOM     11  C   LIG    1       -2.904  -0.802   0.237  0.00  0.00    +0.185 C 
ATOM     12  C   LIG    1       -3.187  -1.079   1.709  0.00  0.00    +0.192 C 
ATOM     13  O   LIG    1       -4.574  -1.344   1.910  0.00  0.00    -0.368 OA
ATOM     14  C   LIG    1       -5.321  -0.176   2.174  0.00  0.00    +0.255 C 
ENDBRANCH   1  11
BRANCH   3  15
ATOM     15  C   LIG    1        0.722  -1.667  -0.560  0.00  0.00    +0.037 A 
ATOM     16  C   LIG    1        1.406  -0.455  -0.384  0.00  0.00    +0.021 A 
ATOM     17  C   LIG    1        2.737  -0.308  -0.813  0.00  0.00    -0.017 A 
ATOM     18  C   LIG    1        3.368  -1.410  -1.414  0.00  0.00    +0.008 A 
ATOM     19  C   LIG    1        2.699  -2.625  -1.576  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1        1.380  -2.754  -1.146  0.00  0.00    +0.013 A 
BRANCH  17  21
ATOM     21  C   LIG    1        3.453   0.964  -0.631  0.00  0.00    -0.018 A 
ATOM     22  C   LIG    1        4.033   1.630  -1.724  0.00  0.00    +0.008 A 
ATOM     23  C   LIG    1        4.710   2.841  -1.553  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        4.819   3.405  -0.284  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        4.253   2.760   0.812  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1        3.576   1.550   0.640  0.00  0.00    +0.008 A 
ENDBRANCH  17  21
ENDBRANCH   3  15
TORSDOF 3