REMARK  Name = BDB017190
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.938  -1.192   0.930  0.00  0.00    +0.167 C 
ATOM      2  O   LIG    1        0.652  -2.010   1.804  0.00  0.00    -0.292 OA
ENDROOT
BRANCH   1   6
ATOM      3  C   LIG    1        5.141  -0.472   0.272  0.00  0.00    +0.120 A 
ATOM      4  C   LIG    1        4.218  -0.089  -0.701  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.848  -0.315  -0.506  0.00  0.00    +0.015 A 
ATOM      6  C   LIG    1        2.388  -0.921   0.668  0.00  0.00    +0.018 A 
ATOM      7  C   LIG    1        3.319  -1.311   1.638  0.00  0.00    +0.015 A 
ATOM      8  C   LIG    1        4.684  -1.085   1.439  0.00  0.00    +0.046 A 
BRANCH   3  10
ATOM      9  C   LIG    1        7.016   0.310  -0.965  0.00  0.00    +0.277 C 
ATOM     10  O   LIG    1        6.497  -0.309   0.205  0.00  0.00    -0.495 OA
ENDBRANCH   3  10
ENDBRANCH   1   6
BRANCH   1  11
ATOM     11  C   LIG    1       -0.129  -0.472   0.107  0.00  0.00    +0.074 C 
ATOM     12  C   LIG    1       -1.533  -1.073   0.361  0.00  0.00    +0.095 C 
ATOM     13  N   LIG    1       -2.651  -0.163   0.029  0.00  0.00    -0.301 NA
ATOM     14  C   LIG    1       -2.283   0.787  -1.017  0.00  0.00    +0.084 C 
ATOM     15  C   LIG    1       -1.190   1.730  -0.497  0.00  0.00    +0.016 C 
ATOM     16  C   LIG    1       -0.160   1.029   0.396  0.00  0.00    +0.014 C 
BRANCH  13  17
ATOM     17  C   LIG    1       -3.878  -0.905  -0.265  0.00  0.00    +0.088 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -5.129  -0.255   0.265  0.00  0.00    +0.003 C 
ATOM     19  C   LIG    1       -5.223   1.177   0.747  0.00  0.00    +0.005 C 
ATOM     20  C   LIG    1       -5.866   0.781  -0.551  0.00  0.00    +0.005 C 
ENDBRANCH  17  18
ENDBRANCH  13  17
ENDBRANCH   1  11
TORSDOF 5