REMARK  Name = BDB030256
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.092  -0.585   0.477  0.00  0.00    +0.019 C 
ATOM      2  C   LIG    1       -1.273  -1.084   1.670  0.00  0.00    +0.024 C 
ATOM      3  C   LIG    1       -0.043  -1.922   1.552  0.00  0.00    +0.113 C 
ATOM      4  N   LIG    1        0.931  -1.068   0.894  0.00  0.00    -0.296 N 
ATOM      5  C   LIG    1        2.197  -1.562   0.616  0.00  0.00    +0.266 C 
ATOM      6  O   LIG    1        2.497  -2.722   0.905  0.00  0.00    -0.268 OA
ATOM      7  C   LIG    1        0.437   0.274   0.622  0.00  0.00    +0.113 C 
ATOM      8  C   LIG    1       -0.982   0.263   1.102  0.00  0.00    +0.024 C 
ATOM      9  C   LIG    1       -1.880  -1.219  -0.879  0.00  0.00    +0.018 C 
ENDROOT
BRANCH   1  14
ATOM     10  C   LIG    1       -6.155   0.408  -0.770  0.00  0.00    +0.058 C 
ATOM     11  C   LIG    1       -5.491   0.855   0.533  0.00  0.00    +0.138 C 
ATOM     12  O   LIG    1       -5.539  -0.241   1.470  0.00  0.00    -0.387 OA
ATOM     13  N   LIG    1       -4.310  -0.944   1.389  0.00  0.00    -0.093 NA
ATOM     14  C   LIG    1       -3.490  -0.169   0.764  0.00  0.00    +0.068 C 
ATOM     15  C   LIG    1       -4.012   1.153   0.357  0.00  0.00    +0.104 C 
ATOM     16  C   LIG    1       -6.240   2.037   1.140  0.00  0.00    +0.058 C 
ENDBRANCH   1  14
BRANCH   5  17
ATOM     17  C   LIG    1        3.183  -0.678  -0.031  0.00  0.00    +0.143 A 
ATOM     18  N   LIG    1        2.981   0.647  -0.409  0.00  0.00    -0.231 NA
ATOM     19  C   LIG    1        4.116   1.044  -0.945  0.00  0.00    +0.200 A 
ATOM     20  N   LIG    1        5.036   0.046  -0.919  0.00  0.00    -0.333 N 
ATOM     21  C   LIG    1        4.476  -1.057  -0.362  0.00  0.00    +0.120 A 
BRANCH  20  22
ATOM     22  C   LIG    1        6.400   0.126  -1.464  0.00  0.00    +0.088 C 
ATOM     23  C   LIG    1        7.613  -0.261  -0.651  0.00  0.00    +0.027 C 
ATOM     24  C   LIG    1        7.386   1.177  -1.011  0.00  0.00    +0.027 C 
ENDBRANCH  20  22
ENDBRANCH   5  17
TORSDOF 3