REMARK  Name = BDB025433
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -6.715  -0.566   0.767  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1       -5.306  -0.886   1.198  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1       -4.278  -0.153   0.620  0.00  0.00    -0.296 N 
ATOM      4  C   LIG    1       -2.921  -0.434   1.135  0.00  0.00    +0.165 C 
ATOM      5  C   LIG    1       -1.875   0.128   0.223  0.00  0.00    +0.086 A 
ATOM      6  N   LIG    1       -0.566  -0.074   0.396  0.00  0.00    -0.165 NA
ATOM      7  N   LIG    1        0.028   0.609  -0.634  0.00  0.00    -0.185 N 
ATOM      8  C   LIG    1       -0.928   1.242  -1.439  0.00  0.00    +0.126 A 
ATOM      9  C   LIG    1        1.433   0.639  -0.777  0.00  0.00    +0.257 C 
ATOM     10  O   LIG    1        1.930   1.328  -1.666  0.00  0.00    -0.270 OA
ATOM     11  C   LIG    1       -2.151   0.946  -0.893  0.00  0.00    +0.018 A 
ATOM     12  C   LIG    1       -3.533   1.303  -1.287  0.00  0.00    +0.059 C 
ATOM     13  C   LIG    1       -4.484   1.127  -0.089  0.00  0.00    +0.113 C 
ATOM     14  O   LIG    1       -5.100  -1.774   2.026  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   9  15
ATOM     15  C   LIG    1        2.197  -0.189   0.248  0.00  0.00    +0.113 C 
ATOM     16  C   LIG    1        3.524  -0.727  -0.283  0.00  0.00    -0.014 A 
ATOM     17  C   LIG    1        4.679  -0.693   0.521  0.00  0.00    +0.031 A 
ATOM     18  C   LIG    1        5.889  -1.162  -0.007  0.00  0.00    +0.023 A 
ATOM     19  C   LIG    1        5.945  -1.742  -1.275  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1        4.790  -1.841  -2.041  0.00  0.00    +0.000 A 
ATOM     21  N   LIG    1        4.685  -0.086   1.788  0.00  0.00    -0.344 N 
ATOM     22  H   LIG    1        5.408  -0.474   2.389  0.00  0.00    +0.146 HD
ATOM     23  C   LIG    1        3.389   0.022   2.436  0.00  0.00    +0.102 C 
ATOM     24  C   LIG    1        3.586  -1.339  -1.549  0.00  0.00    +0.006 A 
ATOM     25  C   LIG    1        2.404   0.686   1.493  0.00  0.00    +0.036 C 
ENDBRANCH   9  15
BRANCH   8  26
ATOM     26  N   LIG    1       -0.618   1.973  -2.532  0.00  0.00    -0.343 N 
ATOM     27  H   LIG    1       -1.286   2.590  -2.985  0.00  0.00    +0.144 HD
ATOM     28  H   LIG    1        0.362   2.204  -2.731  0.00  0.00    +0.144 HD
ENDBRANCH   8  26
TORSDOF 2