REMARK  Name = BDB017114
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.531  -2.340   2.949  0.00  0.00    -0.292 OA
ATOM      2  C   LIG    1       -0.465  -1.981   1.773  0.00  0.00    +0.167 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1       -1.607  -2.231   0.790  0.00  0.00    +0.074 C 
ATOM      4  C   LIG    1       -2.689  -1.153   0.923  0.00  0.00    +0.095 C 
ATOM      5  N   LIG    1       -2.405   0.033   0.106  0.00  0.00    -0.301 NA
ATOM      6  C   LIG    1       -2.270  -0.301  -1.312  0.00  0.00    +0.084 C 
ATOM      7  C   LIG    1       -1.095  -1.253  -1.524  0.00  0.00    +0.016 C 
ATOM      8  C   LIG    1       -1.211  -2.509  -0.665  0.00  0.00    +0.014 C 
BRANCH   5   9
ATOM      9  C   LIG    1       -3.333   1.142   0.352  0.00  0.00    +0.088 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -4.753   0.896  -0.063  0.00  0.00    +0.003 C 
ATOM     11  C   LIG    1       -5.678   2.071  -0.273  0.00  0.00    +0.005 C 
ATOM     12  C   LIG    1       -5.242   1.244  -1.448  0.00  0.00    +0.005 C 
ENDBRANCH   9  10
ENDBRANCH   5   9
ENDBRANCH   2   3
BRANCH   2  13
ATOM     13  C   LIG    1        0.757  -1.283   1.340  0.00  0.00    +0.018 A 
ATOM     14  C   LIG    1        0.781   0.108   1.259  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1        1.956   0.754   0.865  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1        3.121   0.024   0.565  0.00  0.00    -0.018 A 
ATOM     17  C   LIG    1        3.076  -1.377   0.681  0.00  0.00    +0.009 A 
ATOM     18  C   LIG    1        1.905  -2.030   1.074  0.00  0.00    +0.012 A 
BRANCH  16  19
ATOM     19  C   LIG    1        4.356   0.709   0.150  0.00  0.00    -0.018 A 
ATOM     20  C   LIG    1        5.013   0.358  -1.041  0.00  0.00    +0.008 A 
ATOM     21  C   LIG    1        6.186   1.008  -1.436  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1        6.722   2.021  -0.644  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        6.087   2.384   0.541  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        4.914   1.733   0.934  0.00  0.00    +0.008 A 
ENDBRANCH  16  19
ENDBRANCH   2  13
TORSDOF 5