REMARK  Name = BDB020230
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.078   0.518   0.288  0.00  0.00    -0.035 A 
ATOM      2  C   LIG    1       -0.643  -0.650  -0.015  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1       -2.026  -0.592  -0.041  0.00  0.00    -0.029 A 
ATOM      4  C   LIG    1       -3.014  -1.667  -0.344  0.00  0.00    +0.117 C 
ATOM      5  N   LIG    1       -4.335  -1.118   0.057  0.00  0.00    -0.308 NA
ATOM      6  H   LIG    1       -4.479  -1.404   1.026  0.00  0.00    +0.123 HD
ATOM      7  C   LIG    1       -4.172   0.359   0.082  0.00  0.00    +0.117 C 
ATOM      8  C   LIG    1       -2.705   0.596   0.210  0.00  0.00    -0.029 A 
ATOM      9  C   LIG    1       -2.023   1.763   0.495  0.00  0.00    +0.005 A 
ATOM     10  C   LIG    1       -0.626   1.719   0.537  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1        5.375  -1.019  -0.405  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        4.240  -0.584  -0.239  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1        3.451  -1.034   0.788  0.00  0.00    -0.256 N 
ATOM     14  H   LIG    1        3.859  -1.745   1.380  0.00  0.00    +0.157 HD
ATOM     15  C   LIG    1        2.208  -0.582   1.171  0.00  0.00    +0.227 C 
ATOM     16  O   LIG    1        1.686  -1.030   2.189  0.00  0.00    -0.275 OA
ATOM     17  C   LIG    1        1.599   0.525   0.310  0.00  0.00    +0.106 C 
ATOM     18  C   LIG    1        2.146   0.452  -1.119  0.00  0.00    +0.026 C 
ATOM     19  C   LIG    1        3.664   0.516  -1.095  0.00  0.00    +0.097 C 
ENDBRANCH   1  17
TORSDOF 1