REMARK  Name = BDB018299
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.196  -0.679  -0.069  0.00  0.00    +0.024 A 
ATOM      2  C   LIG    1       -1.170  -0.655   0.853  0.00  0.00    +0.117 A 
ATOM      3  N   LIG    1       -0.381  -1.744   0.581  0.00  0.00    -0.264 N 
ATOM      4  N   LIG    1       -0.830  -2.471  -0.466  0.00  0.00    -0.178 NA
ATOM      5  C   LIG    1       -1.934  -1.824  -0.851  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1   7
ATOM      6  C   LIG    1       -4.654  -0.126  -0.450  0.00  0.00    +0.135 A 
ATOM      7  C   LIG    1       -3.262   0.278  -0.187  0.00  0.00    +0.043 A 
ATOM      8  C   LIG    1       -3.009   1.597  -0.066  0.00  0.00    +0.101 A 
ATOM      9  N   LIG    1       -3.989   2.567  -0.184  0.00  0.00    -0.317 N 
ATOM     10  C   LIG    1       -3.604   3.963  -0.052  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -5.313   2.248  -0.446  0.00  0.00    +0.255 A 
ATOM     12  O   LIG    1       -6.225   3.061  -0.571  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -5.617   0.803  -0.574  0.00  0.00    +0.116 A 
BRANCH   6  14
ATOM     14  O   LIG    1       -4.841  -1.490  -0.529  0.00  0.00    -0.491 OA
BRANCH  14  16
ATOM     15  C   LIG    1       -6.901  -2.163   0.564  0.00  0.00    +0.048 C 
ATOM     16  C   LIG    1       -6.142  -2.034  -0.744  0.00  0.00    +0.226 C 
ENDBRANCH  14  16
ENDBRANCH   6  14
ENDBRANCH   1   7
BRANCH   3  17
ATOM     17  C   LIG    1        0.829  -2.132   1.316  0.00  0.00    +0.134 C 
ATOM     18  C   LIG    1        1.119  -3.636   1.277  0.00  0.00    +0.038 C 
BRANCH  17  19
ATOM     19  C   LIG    1        2.025  -1.313   0.854  0.00  0.00    -0.023 A 
ATOM     20  C   LIG    1        2.450  -1.331  -0.483  0.00  0.00    +0.006 A 
ATOM     21  C   LIG    1        3.554  -0.576  -0.894  0.00  0.00    +0.009 A 
ATOM     22  C   LIG    1        4.265   0.209   0.022  0.00  0.00    -0.015 A 
ATOM     23  C   LIG    1        3.844   0.224   1.358  0.00  0.00    +0.009 A 
ATOM     24  C   LIG    1        2.739  -0.528   1.770  0.00  0.00    +0.006 A 
BRANCH  22  25
ATOM     25  C   LIG    1        5.405   0.993  -0.419  0.00  0.00    +0.020 A 
ATOM     26  C   LIG    1        6.493   1.333   0.360  0.00  0.00    +0.116 A 
ATOM     27  N   LIG    1        7.332   2.052  -0.442  0.00  0.00    -0.274 N 
ATOM     28  C   LIG    1        8.607   2.621  -0.077  0.00  0.00    +0.172 C 
ATOM     29  N   LIG    1        6.873   2.208  -1.695  0.00  0.00    -0.179 NA
ATOM     30  C   LIG    1        5.704   1.561  -1.681  0.00  0.00    +0.142 A 
ENDBRANCH  22  25
ENDBRANCH  17  19
ENDBRANCH   3  17
TORSDOF 6