REMARK  Name = BDB018825
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.019  -0.838   0.228  0.00  0.00    +0.241 C 
ATOM      2  N   LIG    1       -0.648  -0.662   0.269  0.00  0.00    -0.269 N 
ATOM      3  C   LIG    1        0.235   0.239  -0.359  0.00  0.00    +0.040 A 
ATOM      4  C   LIG    1        1.560  -0.091  -0.026  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1        2.657   0.638  -0.500  0.00  0.00    -0.011 A 
ATOM      6  C   LIG    1        2.383   1.741  -1.319  0.00  0.00    +0.009 A 
ATOM      7  C   LIG    1        1.066   2.085  -1.647  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        1.607  -1.312   0.844  0.00  0.00    +0.057 C 
ATOM      9  C   LIG    1       -0.013   1.335  -1.167  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1        0.133  -1.515   1.177  0.00  0.00    +0.118 C 
ATOM     11  O   LIG    1       -2.561  -1.633   1.008  0.00  0.00    -0.273 OA
ENDROOT
BRANCH   5  12
ATOM     12  C   LIG    1        4.037   0.283  -0.168  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1        4.796   1.052   0.706  0.00  0.00    +0.143 A 
ATOM     14  N   LIG    1        6.073   0.759   1.036  0.00  0.00    -0.157 NA
ATOM     15  N   LIG    1        6.664  -0.338   0.495  0.00  0.00    -0.158 NA
ATOM     16  C   LIG    1        5.965  -1.110  -0.361  0.00  0.00    +0.135 A 
ATOM     17  C   LIG    1        4.658  -0.837  -0.717  0.00  0.00    +0.031 A 
ENDBRANCH   5  12
BRANCH   1  19
ATOM     18  N   LIG    1       -4.158  -0.748  -1.117  0.00  0.00    -0.258 N 
ATOM     19  C   LIG    1       -2.873  -0.053  -0.773  0.00  0.00    +0.170 C 
ATOM     20  C   LIG    1       -3.334   1.275  -0.173  0.00  0.00    +0.034 C 
ATOM     21  C   LIG    1       -4.612   0.902   0.558  0.00  0.00    +0.022 C 
ATOM     22  C   LIG    1       -5.270  -0.117  -0.359  0.00  0.00    +0.117 C 
BRANCH  18  24
ATOM     23  N   LIG    1       -4.275  -2.985  -2.217  0.00  0.00    -0.174 NA
ATOM     24  C   LIG    1       -4.225  -1.955  -1.692  0.00  0.00    +0.170 C 
ENDBRANCH  18  24
ENDBRANCH   1  19
TORSDOF 3