REMARK  Name = BDB025518
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.351  -0.392   0.353  0.00  0.00    +0.255 C 
ATOM      2  N   LIG    1        1.630   0.041  -0.055  0.00  0.00    -0.200 N 
ATOM      3  C   LIG    1        2.856  -0.501   0.265  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1        3.111  -1.694   1.105  0.00  0.00    +0.215 C 
ATOM      5  O   LIG    1        4.490  -2.089   0.913  0.00  0.00    -0.373 OA
ATOM      6  C   LIG    1        5.420  -0.994   1.014  0.00  0.00    +0.165 C 
ATOM      7  C   LIG    1        5.254  -0.018  -0.168  0.00  0.00    +0.068 C 
ATOM      8  C   LIG    1        3.814   0.294  -0.321  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        3.097   1.280  -1.004  0.00  0.00    +0.142 A 
ATOM     10  N   LIG    1        1.785   1.145  -0.844  0.00  0.00    -0.149 NA
ATOM     11  O   LIG    1        0.271  -1.340   1.129  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  19
ATOM     12  C   LIG    1       -5.843  -0.232   0.359  0.00  0.00    +0.045 C 
ATOM     13  C   LIG    1       -4.493  -0.695  -0.121  0.00  0.00    -0.029 A 
ATOM     14  C   LIG    1       -3.342   0.116   0.004  0.00  0.00    +0.034 A 
ATOM     15  N   LIG    1       -3.441   1.378   0.622  0.00  0.00    -0.343 N 
ATOM     16  H   LIG    1       -4.350   1.805   0.467  0.00  0.00    +0.146 HD
ATOM     17  C   LIG    1       -2.340   2.294   0.377  0.00  0.00    +0.102 C 
ATOM     18  C   LIG    1       -1.032   1.615   0.722  0.00  0.00    +0.036 C 
ATOM     19  C   LIG    1       -0.811   0.416  -0.209  0.00  0.00    +0.113 C 
ATOM     20  C   LIG    1       -2.087  -0.407  -0.379  0.00  0.00    -0.014 A 
ATOM     21  C   LIG    1       -2.022  -1.668  -1.001  0.00  0.00    +0.006 A 
ATOM     22  C   LIG    1       -3.168  -2.437  -1.173  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1       -4.394  -1.959  -0.725  0.00  0.00    +0.005 A 
ENDBRANCH   1  19
BRANCH   9  24
ATOM     24  N   LIG    1        3.652   2.254  -1.728  0.00  0.00    -0.341 N 
ATOM     25  H   LIG    1        3.054   3.022  -2.011  0.00  0.00    +0.144 HD
ATOM     26  H   LIG    1        4.623   2.512  -1.609  0.00  0.00    +0.144 HD
ENDBRANCH   9  24
TORSDOF 2