REMARK  Name = BDB062532
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.669   0.637  -0.195  0.00  0.00    -0.299 N 
ATOM      2  H   LIG    1       -1.020   1.520  -0.538  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -1.692  -0.278   0.097  0.00  0.00    +0.135 A 
ATOM      4  C   LIG    1       -3.047   0.071  -0.094  0.00  0.00    +0.059 A 
ATOM      5  C   LIG    1       -3.997  -0.889   0.217  0.00  0.00    +0.143 A 
ATOM      6  N   LIG    1       -5.237  -0.367  -0.033  0.00  0.00    -0.346 N 
ATOM      7  H   LIG    1       -6.098  -0.873   0.115  0.00  0.00    +0.167 HD
ATOM      8  C   LIG    1       -5.113   0.915  -0.501  0.00  0.00    +0.085 A 
ATOM      9  N   LIG    1       -3.777  -2.124   0.685  0.00  0.00    -0.218 NA
ATOM     10  C   LIG    1       -2.463  -2.357   0.831  0.00  0.00    +0.225 A 
ATOM     11  C   LIG    1       -3.767   1.216  -0.551  0.00  0.00    +0.032 A 
ATOM     12  N   LIG    1       -1.437  -1.525   0.570  0.00  0.00    -0.220 NA
ENDBRANCH   1   3
BRANCH   1  16
ATOM     13  C   LIG    1        3.567   0.563   0.026  0.00  0.00    +0.120 A 
ATOM     14  C   LIG    1        2.879   1.689  -0.422  0.00  0.00    +0.047 A 
ATOM     15  C   LIG    1        1.482   1.692  -0.487  0.00  0.00    +0.027 A 
ATOM     16  C   LIG    1        0.731   0.569  -0.105  0.00  0.00    +0.033 A 
ATOM     17  C   LIG    1        1.436  -0.552   0.342  0.00  0.00    +0.027 A 
ATOM     18  C   LIG    1        2.838  -0.559   0.409  0.00  0.00    +0.047 A 
BRANCH  13  20
ATOM     19  C   LIG    1        5.668  -0.439   0.494  0.00  0.00    +0.277 C 
ATOM     20  O   LIG    1        4.928   0.688   0.043  0.00  0.00    -0.495 OA
ENDBRANCH  13  20
ENDBRANCH   1  16
TORSDOF 3