REMARK  Name = BDB018657
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.026   0.348   0.069  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1        1.175  -0.326   0.961  0.00  0.00    +0.032 A 
ATOM      3  C   LIG    1       -0.201  -0.090   0.945  0.00  0.00    +0.037 A 
ATOM      4  N   LIG    1       -1.028  -0.762   1.850  0.00  0.00    -0.285 N 
ATOM      5  H   LIG    1       -0.618  -1.287   2.613  0.00  0.00    +0.155 HD
ATOM      6  C   LIG    1       -2.397  -0.680   1.849  0.00  0.00    +0.225 C 
ATOM      7  C   LIG    1       -3.033  -0.084   0.601  0.00  0.00    +0.069 C 
ATOM      8  C   LIG    1       -4.504   0.270   0.838  0.00  0.00    +0.132 C 
ATOM      9  N   LIG    1       -5.133   0.193  -0.513  0.00  0.00    -0.268 N 
ATOM     10  C   LIG    1       -4.288  -0.663  -1.384  0.00  0.00    +0.117 C 
ATOM     11  C   LIG    1       -2.230   1.142   0.138  0.00  0.00    +0.054 C 
ATOM     12  C   LIG    1       -3.157  -1.158  -0.490  0.00  0.00    +0.037 C 
ATOM     13  O   LIG    1       -3.044  -1.158   2.778  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -0.757   0.835   0.059  0.00  0.00    -0.025 A 
ATOM     15  C   LIG    1        0.079   1.522  -0.823  0.00  0.00    +0.006 A 
ATOM     16  C   LIG    1        1.455   1.272  -0.823  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  20
ATOM     17  C   LIG    1        6.260  -0.385   0.072  0.00  0.00    +0.052 A 
ATOM     18  C   LIG    1        5.523  -0.526  -1.106  0.00  0.00    +0.019 A 
ATOM     19  C   LIG    1        4.145  -0.286  -1.105  0.00  0.00    +0.010 A 
ATOM     20  C   LIG    1        3.476   0.098   0.070  0.00  0.00    -0.018 A 
ATOM     21  C   LIG    1        4.233   0.235   1.246  0.00  0.00    +0.010 A 
ATOM     22  C   LIG    1        5.612  -0.003   1.249  0.00  0.00    +0.019 A 
BRANCH  17  24
ATOM     23  N   LIG    1        8.816  -0.828   0.074  0.00  0.00    -0.191 NA
ATOM     24  C   LIG    1        7.673  -0.629   0.073  0.00  0.00    +0.099 C 
ENDBRANCH  17  24
ENDBRANCH   1  20
BRANCH   9  25
ATOM     25  C   LIG    1       -6.419   0.477  -0.759  0.00  0.00    +0.169 C 
ATOM     26  N   LIG    1       -7.528   0.723  -0.976  0.00  0.00    -0.174 NA
ENDBRANCH   9  25
TORSDOF 3