REMARK  Name = BDB017306
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.108   0.784   0.254  0.00  0.00    +0.181 C 
ATOM      2  O   LIG    1       -0.332   1.704   1.045  0.00  0.00    -0.290 OA
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.282   0.234   0.190  0.00  0.00    +0.020 A 
ATOM      4  C   LIG    1        2.324   1.026   0.693  0.00  0.00    +0.020 A 
ATOM      5  C   LIG    1        3.655   0.578   0.670  0.00  0.00    -0.017 A 
ATOM      6  C   LIG    1        3.946  -0.694   0.135  0.00  0.00    -0.014 A 
ATOM      7  C   LIG    1        5.278  -1.140   0.112  0.00  0.00    +0.054 A 
ATOM      8  C   LIG    1        6.318  -0.348   0.608  0.00  0.00    +0.121 A 
ATOM      9  C   LIG    1        6.026   0.907   1.136  0.00  0.00    +0.046 A 
ATOM     10  C   LIG    1        2.898  -1.486  -0.358  0.00  0.00    +0.009 A 
ATOM     11  C   LIG    1        4.704   1.366   1.167  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1        1.576  -1.030  -0.329  0.00  0.00    +0.012 A 
BRANCH   8  13
ATOM     13  O   LIG    1        7.559  -0.914   0.518  0.00  0.00    -0.495 OA
ATOM     14  C   LIG    1        8.653  -0.150   1.011  0.00  0.00    +0.277 C 
ENDBRANCH   8  13
ENDBRANCH   1   3
BRANCH   1  16
ATOM     15  N   LIG    1       -2.033   1.203  -1.342  0.00  0.00    -0.291 NA
ATOM     16  C   LIG    1       -1.202   0.175  -0.641  0.00  0.00    +0.142 C 
ATOM     17  C   LIG    1       -2.022  -0.794   0.264  0.00  0.00    +0.111 C 
ATOM     18  N   LIG    1       -3.404  -0.980  -0.197  0.00  0.00    -0.296 NA
ATOM     19  C   LIG    1       -4.117   0.306  -0.276  0.00  0.00    +0.100 C 
ATOM     20  C   LIG    1       -3.213   1.545  -0.541  0.00  0.00    +0.100 C 
BRANCH  18  21
ATOM     21  C   LIG    1       -4.055  -2.085   0.512  0.00  0.00    +0.057 C 
ATOM     22  C   LIG    1       -4.383  -1.796   1.994  0.00  0.00    +0.019 C 
ATOM     23  C   LIG    1       -5.703  -2.569   1.757  0.00  0.00    +0.003 C 
ATOM     24  C   LIG    1       -5.575  -2.192   0.260  0.00  0.00    +0.019 C 
ENDBRANCH  18  21
BRANCH  15  26
ATOM     25  C   LIG    1       -2.010   3.079  -2.963  0.00  0.00    +0.020 C 
ATOM     26  C   LIG    1       -1.279   2.355  -1.836  0.00  0.00    +0.082 C 
ENDBRANCH  15  26
ENDBRANCH   1  16
TORSDOF 5