REMARK  Name = BDB018656
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.165  -0.408  -0.275  0.00  0.00    -0.013 A 
ATOM      2  C   LIG    1        1.361  -0.195   0.854  0.00  0.00    +0.032 A 
ATOM      3  C   LIG    1       -0.011  -0.441   0.795  0.00  0.00    +0.037 A 
ATOM      4  N   LIG    1       -0.798  -0.238   1.932  0.00  0.00    -0.285 N 
ATOM      5  H   LIG    1       -0.354  -0.073   2.828  0.00  0.00    +0.155 HD
ATOM      6  C   LIG    1       -2.163  -0.353   1.958  0.00  0.00    +0.225 C 
ATOM      7  C   LIG    1       -2.868  -0.405   0.609  0.00  0.00    +0.069 C 
ATOM      8  C   LIG    1       -3.058   1.031   0.101  0.00  0.00    +0.132 C 
ATOM      9  N   LIG    1       -4.261   0.975  -0.779  0.00  0.00    -0.268 N 
ATOM     10  C   LIG    1       -5.016  -0.268  -0.485  0.00  0.00    +0.117 C 
ATOM     11  C   LIG    1       -2.069  -1.268  -0.380  0.00  0.00    +0.054 C 
ATOM     12  C   LIG    1       -4.322  -0.877   0.726  0.00  0.00    +0.037 C 
ATOM     13  O   LIG    1       -2.760  -0.316   3.032  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -0.604  -0.920  -0.376  0.00  0.00    -0.025 A 
ATOM     15  C   LIG    1        0.195  -1.149  -1.499  0.00  0.00    +0.006 A 
ATOM     16  C   LIG    1        1.568  -0.888  -1.450  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  21
ATOM     17  C   LIG    1        6.607   1.533   0.808  0.00  0.00    +0.172 C 
ATOM     18  N   LIG    1        5.549   0.724   0.253  0.00  0.00    -0.274 N 
ATOM     19  N   LIG    1        5.849  -0.231  -0.644  0.00  0.00    -0.179 NA
ATOM     20  C   LIG    1        4.660  -0.760  -0.945  0.00  0.00    +0.142 A 
ATOM     21  C   LIG    1        3.595  -0.154  -0.238  0.00  0.00    +0.020 A 
ATOM     22  C   LIG    1        4.215   0.810   0.531  0.00  0.00    +0.116 A 
ENDBRANCH   1  21
BRANCH   9  23
ATOM     23  C   LIG    1       -4.756   2.023  -1.449  0.00  0.00    +0.169 C 
ATOM     24  N   LIG    1       -5.185   2.929  -2.027  0.00  0.00    -0.174 NA
ENDBRANCH   9  23
TORSDOF 2