REMARK  Name = BDB001774
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.432   1.415  -0.635  0.00  0.00    -0.311 OA
ENDROOT
BRANCH   1  10
ATOM      2  C   LIG    1        3.579  -0.440   2.523  0.00  0.00    +0.034 C 
ATOM      3  C   LIG    1        3.785   0.096   1.094  0.00  0.00    +0.018 C 
ATOM      4  C   LIG    1        5.144   0.174   0.380  0.00  0.00    +0.188 C 
ATOM      5  O   LIG    1        6.184  -0.237   0.885  0.00  0.00    -0.287 OA
ATOM      6  C   LIG    1        5.093   0.821  -1.016  0.00  0.00    +0.018 C 
ATOM      7  C   LIG    1        6.330   1.075  -1.897  0.00  0.00    +0.034 C 
ATOM      8  C   LIG    1        3.930   1.227  -1.429  0.00  0.00    +0.021 C 
ATOM      9  C   LIG    1        2.654   1.173  -0.822  0.00  0.00    +0.120 C 
ATOM     10  N   LIG    1        1.602   1.603  -1.410  0.00  0.00    -0.073 NA
ATOM     11  C   LIG    1        2.761   0.580   0.458  0.00  0.00    +0.021 C 
ENDBRANCH   1  10
BRANCH   1  12
ATOM     12  C   LIG    1       -0.149   0.209  -0.929  0.00  0.00    +0.366 C 
ATOM     13  O   LIG    1        0.362  -0.700  -1.568  0.00  0.00    -0.243 OA
BRANCH  12  14
ATOM     14  C   LIG    1       -1.494   0.109  -0.298  0.00  0.00    +0.063 A 
ATOM     15  C   LIG    1       -2.159  -1.124  -0.360  0.00  0.00    +0.047 A 
ATOM     16  C   LIG    1       -3.428  -1.257   0.221  0.00  0.00    +0.127 A 
ATOM     17  C   LIG    1       -4.038  -0.170   0.860  0.00  0.00    +0.033 A 
ATOM     18  C   LIG    1       -3.375   1.056   0.916  0.00  0.00    +0.003 A 
ATOM     19  C   LIG    1       -2.109   1.198   0.340  0.00  0.00    +0.015 A 
BRANCH  16  20
ATOM     20  N   LIG    1       -4.126  -2.548   0.159  0.00  0.00    +0.056 N 
ATOM     21  O   LIG    1       -5.264  -2.610   0.643  0.00  0.00    -0.126 OA
ATOM     22  O   LIG    1       -3.533  -3.497  -0.372  0.00  0.00    -0.126 OA
ENDBRANCH  16  20
ENDBRANCH  12  14
ENDBRANCH   1  12
TORSDOF 4