REMARK  Name = BDB065016
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.722   0.621  -1.202  0.00  0.00    -0.015 A 
ATOM      2  C   LIG    1        0.397   0.224  -1.004  0.00  0.00    +0.022 A 
ATOM      3  C   LIG    1       -0.661   1.172  -0.963  0.00  0.00    +0.041 A 
ATOM      4  C   LIG    1       -0.367   2.531  -1.145  0.00  0.00    +0.076 A 
ATOM      5  N   LIG    1       -1.305   3.480  -1.142  0.00  0.00    -0.235 NA
ATOM      6  C   LIG    1       -2.565   3.070  -0.977  0.00  0.00    +0.223 A 
ATOM      7  N   LIG    1       -2.973   1.805  -0.804  0.00  0.00    -0.220 NA
ATOM      8  C   LIG    1        0.954   2.910  -1.339  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1       -2.021   0.861  -0.750  0.00  0.00    +0.130 A 
ATOM     10  C   LIG    1        1.996   1.977  -1.365  0.00  0.00    +0.011 A 
ENDROOT
BRANCH   1  16
ATOM     11  C   LIG    1        7.903  -1.522   0.806  0.00  0.00    +0.065 C 
ATOM     12  C   LIG    1        6.539  -1.112   0.327  0.00  0.00    +0.041 A 
ATOM     13  N   LIG    1        5.936  -1.939  -0.560  0.00  0.00    -0.234 NA
ATOM     14  C   LIG    1        4.720  -1.516  -0.949  0.00  0.00    +0.139 A 
ATOM     15  C   LIG    1        4.051  -0.365  -0.551  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1        2.796  -0.356  -1.236  0.00  0.00    +0.009 A 
ATOM     17  C   LIG    1        2.749  -1.499  -2.016  0.00  0.00    +0.093 A 
ATOM     18  C   LIG    1        4.708   0.463   0.375  0.00  0.00    +0.014 A 
ATOM     19  N   LIG    1        3.922  -2.186  -1.833  0.00  0.00    -0.345 N 
ATOM     20  H   LIG    1        4.186  -3.055  -2.273  0.00  0.00    +0.167 HD
ATOM     21  C   LIG    1        5.975   0.070   0.812  0.00  0.00    +0.024 A 
ENDBRANCH   1  16
BRANCH   9  22
ATOM     22  N   LIG    1       -2.395  -0.475  -0.532  0.00  0.00    -0.319 N 
ATOM     23  H   LIG    1       -1.770  -0.850   0.176  0.00  0.00    +0.148 HD
BRANCH  22  24
ATOM     24  CA  LIG    1       -3.786  -0.850  -0.191  0.00  0.00    +0.127 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -4.224  -0.300   1.161  0.00  0.00    -0.025 A 
ATOM     26  C   LIG    1       -3.583  -0.757   2.329  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -3.956  -0.285   3.590  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -4.978   0.652   3.707  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -5.626   1.114   2.565  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -5.253   0.642   1.303  0.00  0.00    +0.005 A 
ENDBRANCH  24  25
BRANCH  24  31
ATOM     31  C   LIG    1       -4.763  -0.760  -1.399  0.00  0.00    +0.182 C 
BRANCH  31  32
ATOM     32  O   LIG    1       -5.089   0.552  -1.847  0.00  0.00    -0.393 OA
ATOM     33  H   LIG    1       -4.307   1.104  -1.632  0.00  0.00    +0.209 HD
ENDBRANCH  31  32
ENDBRANCH  24  31
ENDBRANCH  22  24
ENDBRANCH   9  22
TORSDOF 6