REMARK  Name = BDB017280
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.649   0.570   1.908  0.00  0.00    +0.167 C 
ATOM      2  O   LIG    1        1.164   1.167   2.853  0.00  0.00    -0.292 OA
ENDROOT
BRANCH   1   9
ATOM      3  C   LIG    1        6.327  -3.148  -2.179  0.00  0.00    +0.065 C 
ATOM      4  C   LIG    1        5.448  -2.395  -1.225  0.00  0.00    +0.039 A 
ATOM      5  N   LIG    1        4.146  -2.248  -1.567  0.00  0.00    -0.252 NA
ATOM      6  C   LIG    1        3.333  -1.578  -0.733  0.00  0.00    +0.071 A 
ATOM      7  C   LIG    1        3.784  -1.024   0.481  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        2.892  -0.331   1.320  0.00  0.00    +0.021 A 
ATOM      9  C   LIG    1        1.544  -0.180   0.969  0.00  0.00    +0.018 A 
ATOM     10  C   LIG    1        1.101  -0.726  -0.237  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1        5.134  -1.188   0.813  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1        1.997  -1.415  -1.067  0.00  0.00    +0.029 A 
ATOM     13  C   LIG    1        5.977  -1.881  -0.048  0.00  0.00    +0.023 A 
ENDBRANCH   1   9
BRANCH   1  14
ATOM     14  C   LIG    1       -0.856   0.597   1.661  0.00  0.00    +0.074 C 
ATOM     15  C   LIG    1       -1.197   1.778   0.747  0.00  0.00    +0.095 C 
ATOM     16  N   LIG    1       -2.618   1.835   0.361  0.00  0.00    -0.301 NA
ATOM     17  C   LIG    1       -3.521   1.273   1.380  0.00  0.00    +0.084 C 
ATOM     18  C   LIG    1       -2.977   1.438   2.798  0.00  0.00    +0.016 C 
ATOM     19  C   LIG    1       -1.653   0.692   2.976  0.00  0.00    +0.014 C 
BRANCH  16  20
ATOM     20  C   LIG    1       -2.852   1.258  -0.967  0.00  0.00    +0.088 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -4.219   1.613  -1.473  0.00  0.00    +0.003 C 
ATOM     22  C   LIG    1       -4.764   0.925  -2.700  0.00  0.00    +0.005 C 
ATOM     23  C   LIG    1       -5.375   0.651  -1.356  0.00  0.00    +0.005 C 
ENDBRANCH  20  21
ENDBRANCH  16  20
ENDBRANCH   1  14
TORSDOF 4