REMARK  Name = BDB017188
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.814  -1.514   0.698  0.00  0.00    +0.168 C 
ATOM      2  O   LIG    1        0.282  -2.445   1.303  0.00  0.00    -0.292 OA
ENDROOT
BRANCH   1   5
ATOM      3  C   LIG    1        4.402  -0.558  -0.227  0.00  0.00    +0.121 A 
ATOM      4  C   LIG    1        3.012  -0.485  -0.074  0.00  0.00    +0.057 A 
ATOM      5  C   LIG    1        2.300  -1.540   0.510  0.00  0.00    +0.021 A 
ATOM      6  C   LIG    1        3.002  -2.673   0.943  0.00  0.00    +0.011 A 
ATOM      7  C   LIG    1        4.386  -2.749   0.791  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1        5.087  -1.693   0.206  0.00  0.00    +0.045 A 
BRANCH   3  10
ATOM      9  C   LIG    1        6.376   0.527  -0.995  0.00  0.00    +0.277 C 
ATOM     10  O   LIG    1        4.965   0.544  -0.811  0.00  0.00    -0.495 OA
ENDBRANCH   3  10
ENDBRANCH   1   5
BRANCH   1  11
ATOM     11  C   LIG    1        0.001  -0.341   0.153  0.00  0.00    +0.074 C 
ATOM     12  C   LIG    1       -1.457  -0.778  -0.092  0.00  0.00    +0.095 C 
ATOM     13  N   LIG    1       -2.284   0.410  -0.345  0.00  0.00    -0.301 NA
ATOM     14  C   LIG    1       -2.405   1.238   0.869  0.00  0.00    +0.084 C 
ATOM     15  C   LIG    1       -1.216   1.112   1.833  0.00  0.00    +0.016 C 
ATOM     16  C   LIG    1        0.095   0.874   1.093  0.00  0.00    +0.014 C 
BRANCH  13  17
ATOM     17  C   LIG    1       -3.593   0.039  -0.893  0.00  0.00    +0.088 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -4.298   1.251  -1.430  0.00  0.00    +0.003 C 
ATOM     19  C   LIG    1       -5.343   1.977  -0.619  0.00  0.00    +0.005 C 
ATOM     20  C   LIG    1       -5.755   1.161  -1.811  0.00  0.00    +0.005 C 
ENDBRANCH  17  18
ENDBRANCH  13  17
ENDBRANCH   1  11
TORSDOF 5