REMARK  Name = BDB026643
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.016  -2.338  -2.521  0.00  0.00    -0.274 OA
ATOM      2  C   LIG    1        0.743  -1.558  -1.945  0.00  0.00    +0.237 C 
ATOM      3  N   LIG    1        0.435  -0.901  -0.767  0.00  0.00    -0.282 N 
ATOM      4  H   LIG    1        1.135  -0.286  -0.361  0.00  0.00    +0.155 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1       -0.764  -1.018  -0.028  0.00  0.00    +0.070 A 
ATOM      6  C   LIG    1       -0.916  -0.290   1.138  0.00  0.00    +0.138 A 
ATOM      7  N   LIG    1       -2.020  -0.312   1.916  0.00  0.00    -0.234 NA
ATOM      8  C   LIG    1       -3.025  -1.114   1.513  0.00  0.00    +0.160 A 
ATOM      9  N   LIG    1       -2.980  -1.872   0.399  0.00  0.00    -0.234 NA
ATOM     10  C   LIG    1       -1.852  -1.802  -0.349  0.00  0.00    +0.138 A 
BRANCH   8  11
ATOM     11  C   LIG    1       -4.249  -1.166   2.340  0.00  0.00    +0.019 A 
ATOM     12  C   LIG    1       -4.404  -0.351   3.479  0.00  0.00    +0.011 A 
ATOM     13  C   LIG    1       -5.565  -0.395   4.259  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -6.601  -1.260   3.918  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1       -6.477  -2.079   2.800  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -5.315  -2.030   2.022  0.00  0.00    +0.011 A 
ENDBRANCH   8  11
ENDBRANCH   3   5
BRANCH   2  17
ATOM     17  C   LIG    1        2.095  -1.248  -2.575  0.00  0.00    +0.219 C 
BRANCH  17  18
ATOM     18  N   LIG    1        3.036  -0.578  -1.701  0.00  0.00    -0.325 N 
ATOM     19  C   LIG    1        3.270   0.765  -1.600  0.00  0.00    +0.042 A 
ATOM     20  C   LIG    1        2.686   1.882  -2.386  0.00  0.00    +0.055 C 
ATOM     21  C   LIG    1        3.477   3.179  -2.106  0.00  0.00    +0.006 C 
ATOM     22  C   LIG    1        3.831   3.355  -0.613  0.00  0.00    +0.007 C 
ATOM     23  C   LIG    1        4.693   2.193  -0.077  0.00  0.00    +0.057 C 
ATOM     24  C   LIG    1        4.152   0.895  -0.551  0.00  0.00    +0.062 A 
ATOM     25  N   LIG    1        4.464  -0.322  -0.018  0.00  0.00    -0.240 NA
ATOM     26  C   LIG    1        3.804  -1.195  -0.747  0.00  0.00    +0.200 A 
ENDBRANCH  17  18
ENDBRANCH   2  17
TORSDOF 4