REMARK  Name = BDB026716
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        6.813  -1.446  -1.017  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1        5.778  -0.906  -0.634  0.00  0.00    +0.219 C 
ATOM      3  N   LIG    1        4.636  -0.950  -1.380  0.00  0.00    -0.270 N 
ATOM      4  H   LIG    1        4.678  -1.378  -2.294  0.00  0.00    +0.156 HD
ATOM      5  C   LIG    1        3.414  -0.427  -0.983  0.00  0.00    +0.128 A 
ATOM      6  C   LIG    1        3.254   0.017   0.329  0.00  0.00    -0.006 A 
ATOM      7  C   LIG    1        2.005   0.513   0.709  0.00  0.00    +0.021 A 
ATOM      8  C   LIG    1        0.979   0.544  -0.233  0.00  0.00    +0.056 A 
ATOM      9  C   LIG    1        1.243   0.105  -1.523  0.00  0.00    +0.126 A 
ATOM     10  C   LIG    1        4.375  -0.148   1.311  0.00  0.00    +0.048 C 
ATOM     11  N   LIG    1        2.436  -0.407  -1.910  0.00  0.00    -0.239 NA
ATOM     12  C   LIG    1        5.728  -0.065   0.622  0.00  0.00    +0.101 C 
ENDROOT
BRANCH   8  13
ATOM     13  C   LIG    1       -0.340   1.099   0.114  0.00  0.00    +0.252 C 
ATOM     14  N   LIG    1       -1.469   0.262  -0.006  0.00  0.00    -0.267 N 
ATOM     15  C   LIG    1       -2.814   0.789   0.077  0.00  0.00    +0.040 A 
ATOM     16  C   LIG    1       -3.913  -0.075   0.277  0.00  0.00    -0.026 A 
ATOM     17  C   LIG    1       -5.218   0.442   0.382  0.00  0.00    +0.005 A 
ATOM     18  C   LIG    1       -5.455   1.805   0.245  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -4.391   2.661   0.000  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1       -3.734  -1.561   0.421  0.00  0.00    +0.038 C 
ATOM     21  C   LIG    1       -2.496  -2.004  -0.328  0.00  0.00    +0.024 C 
ATOM     22  C   LIG    1       -3.088   2.156  -0.088  0.00  0.00    +0.024 A 
ATOM     23  C   LIG    1       -1.310  -1.193   0.158  0.00  0.00    +0.114 C 
ATOM     24  O   LIG    1       -0.321   2.267   0.494  0.00  0.00    -0.270 OA
ENDBRANCH   8  13
TORSDOF 1