REMARK  Name = BDB017187
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.610   0.782  -0.319  0.00  0.00    +0.168 C 
ATOM      2  O   LIG    1        0.414   1.884  -0.831  0.00  0.00    -0.292 OA
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        2.020   0.370  -0.020  0.00  0.00    +0.021 A 
ATOM      4  C   LIG    1        3.038   1.317  -0.208  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1        4.367   0.983   0.048  0.00  0.00    +0.163 A 
ATOM      6  O   LIG    1        5.303   1.960  -0.180  0.00  0.00    -0.485 OA
ATOM      7  C   LIG    1        6.628   1.415  -0.220  0.00  0.00    +0.270 C 
ATOM      8  C   LIG    1        6.846   0.452   0.935  0.00  0.00    +0.270 C 
ATOM      9  O   LIG    1        5.971  -0.677   0.826  0.00  0.00    -0.485 OA
ATOM     10  C   LIG    1        4.692  -0.290   0.521  0.00  0.00    +0.162 A 
ATOM     11  C   LIG    1        3.691  -1.242   0.696  0.00  0.00    +0.050 A 
ATOM     12  C   LIG    1        2.358  -0.916   0.427  0.00  0.00    +0.015 A 
ENDBRANCH   1   3
BRANCH   1  15
ATOM     13  N   LIG    1       -2.978  -0.296   0.278  0.00  0.00    -0.302 NA
ATOM     14  C   LIG    1       -1.837   0.629   0.237  0.00  0.00    +0.095 C 
ATOM     15  C   LIG    1       -0.540  -0.170   0.002  0.00  0.00    +0.074 C 
ATOM     16  C   LIG    1       -0.699  -1.226  -1.106  0.00  0.00    +0.014 C 
ATOM     17  C   LIG    1       -1.961  -0.991  -1.927  0.00  0.00    +0.016 C 
ATOM     18  C   LIG    1       -3.212  -0.910  -1.041  0.00  0.00    +0.084 C 
BRANCH  13  19
ATOM     19  C   LIG    1       -4.180   0.365   0.809  0.00  0.00    +0.084 C 
BRANCH  19  21
ATOM     20  C   LIG    1       -6.517   0.079   1.714  0.00  0.00    +0.005 C 
ATOM     21  C   LIG    1       -5.325  -0.620   1.077  0.00  0.00    +0.012 C 
ENDBRANCH  19  21
ENDBRANCH  13  19
ENDBRANCH   1  15
TORSDOF 4