REMARK  Name = BDB030258
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.920   0.243  -1.862  0.00  0.00    +0.018 C 
ATOM      2  C   LIG    1       -2.312   0.631  -0.455  0.00  0.00    +0.019 C 
ATOM      3  C   LIG    1       -1.331   0.404   0.699  0.00  0.00    +0.024 C 
ATOM      4  C   LIG    1        0.125   0.107   0.514  0.00  0.00    +0.113 C 
ATOM      5  N   LIG    1        0.678   1.315  -0.081  0.00  0.00    -0.296 N 
ATOM      6  C   LIG    1        1.995   1.532  -0.455  0.00  0.00    +0.266 C 
ATOM      7  O   LIG    1        2.342   2.610  -0.944  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -0.299   2.377  -0.249  0.00  0.00    +0.113 C 
ATOM      9  C   LIG    1       -1.588   1.794   0.227  0.00  0.00    +0.024 C 
ENDROOT
BRANCH   2  10
ATOM     10  C   LIG    1       -3.758   0.474  -0.139  0.00  0.00    +0.068 C 
ATOM     11  C   LIG    1       -4.335  -0.832   0.270  0.00  0.00    +0.105 C 
ATOM     12  C   LIG    1       -5.742  -0.411   0.426  0.00  0.00    +0.144 C 
ATOM     13  C   LIG    1       -6.632  -0.975   1.499  0.00  0.00    +0.055 C 
ATOM     14  C   LIG    1       -6.891  -1.306   0.056  0.00  0.00    +0.055 C 
ATOM     15  O   LIG    1       -5.875   0.996   0.126  0.00  0.00    -0.387 OA
ATOM     16  N   LIG    1       -4.580   1.469  -0.225  0.00  0.00    -0.093 NA
ENDBRANCH   2  10
BRANCH   6  17
ATOM     17  C   LIG    1        2.981   0.455  -0.258  0.00  0.00    +0.143 A 
ATOM     18  N   LIG    1        2.731  -0.805   0.282  0.00  0.00    -0.231 NA
ATOM     19  C   LIG    1        3.885  -1.437   0.268  0.00  0.00    +0.200 A 
ATOM     20  N   LIG    1        4.862  -0.644  -0.241  0.00  0.00    -0.333 N 
ATOM     21  C   LIG    1        4.324   0.549  -0.596  0.00  0.00    +0.120 A 
BRANCH  20  22
ATOM     22  C   LIG    1        6.267  -1.037  -0.437  0.00  0.00    +0.088 C 
ATOM     23  C   LIG    1        7.414  -0.199   0.077  0.00  0.00    +0.027 C 
ATOM     24  C   LIG    1        7.128  -1.533   0.699  0.00  0.00    +0.027 C 
ENDBRANCH  20  22
ENDBRANCH   6  17
TORSDOF 3