REMARK  Name = BDB017183
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.487  -1.399   0.237  0.00  0.00    +0.168 C 
ATOM      2  O   LIG    1       -0.353  -2.341   1.019  0.00  0.00    -0.292 OA
ENDROOT
BRANCH   1   5
ATOM      3  N   LIG    1        2.827   0.186  -0.590  0.00  0.00    -0.302 NA
ATOM      4  C   LIG    1        1.538   0.025   0.091  0.00  0.00    +0.095 C 
ATOM      5  C   LIG    1        0.649  -0.964  -0.683  0.00  0.00    +0.074 C 
ATOM      6  C   LIG    1        1.439  -2.182  -1.202  0.00  0.00    +0.014 C 
ATOM      7  C   LIG    1        2.760  -2.339  -0.461  0.00  0.00    +0.016 C 
ATOM      8  C   LIG    1        3.611  -1.064  -0.550  0.00  0.00    +0.084 C 
BRANCH   3   9
ATOM      9  C   LIG    1        3.579   1.331  -0.053  0.00  0.00    +0.084 C 
BRANCH   9  11
ATOM     10  C   LIG    1        5.519   2.913  -0.361  0.00  0.00    +0.005 C 
ATOM     11  C   LIG    1        4.823   1.665  -0.885  0.00  0.00    +0.012 C 
ENDBRANCH   9  11
ENDBRANCH   3   9
ENDBRANCH   1   5
BRANCH   1  12
ATOM     12  C   LIG    1       -1.790  -0.659   0.224  0.00  0.00    +0.021 A 
ATOM     13  C   LIG    1       -2.869  -1.218   0.925  0.00  0.00    +0.060 A 
ATOM     14  C   LIG    1       -4.114  -0.579   0.958  0.00  0.00    +0.162 A 
ATOM     15  C   LIG    1       -4.287   0.643   0.278  0.00  0.00    +0.162 A 
ATOM     16  C   LIG    1       -3.209   1.202  -0.415  0.00  0.00    +0.050 A 
ATOM     17  C   LIG    1       -1.967   0.557  -0.441  0.00  0.00    +0.015 A 
BRANCH  14  18
ATOM     18  O   LIG    1       -5.217  -1.063   1.617  0.00  0.00    -0.491 OA
ATOM     19  C   LIG    1       -5.075  -2.278   2.340  0.00  0.00    +0.277 C 
ENDBRANCH  14  18
BRANCH  15  20
ATOM     20  O   LIG    1       -5.535   1.206   0.356  0.00  0.00    -0.491 OA
ATOM     21  C   LIG    1       -5.753   2.431  -0.329  0.00  0.00    +0.277 C 
ENDBRANCH  15  20
ENDBRANCH   1  12
TORSDOF 6