REMARK  Name = BDB025333
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.532  -0.053   0.894  0.00  0.00    -0.305 N 
ATOM      2  C   LIG    1        0.659   0.169   0.273  0.00  0.00    +0.217 A 
ATOM      3  N   LIG    1        1.575  -0.661   0.870  0.00  0.00    -0.284 N 
ATOM      4  C   LIG    1        2.783  -0.468   0.276  0.00  0.00    +0.075 A 
ATOM      5  C   LIG    1        2.498   0.503  -0.700  0.00  0.00    +0.091 A 
ATOM      6  C   LIG    1        3.539   0.952  -1.527  0.00  0.00    +0.030 A 
ATOM      7  C   LIG    1        4.822   0.418  -1.352  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        5.072  -0.548  -0.373  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1        4.054  -1.016   0.466  0.00  0.00    +0.028 A 
ATOM     10  C   LIG    1        0.968  -1.423   1.851  0.00  0.00    +0.112 A 
ATOM     11  N   LIG    1        1.161   0.882  -0.693  0.00  0.00    -0.212 NA
ATOM     12  C   LIG    1       -0.332  -1.057   1.853  0.00  0.00    +0.108 A 
ENDROOT
BRANCH   1  19
ATOM     13  O   LIG    1       -5.859   0.632  -0.203  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -4.643   0.596  -0.039  0.00  0.00    +0.219 C 
ATOM     15  N   LIG    1       -4.083   0.899   1.177  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -4.732   1.114   1.922  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -2.752   0.864   1.535  0.00  0.00    +0.242 C 
ATOM     18  O   LIG    1       -2.437   1.112   2.698  0.00  0.00    -0.273 OA
ATOM     19  C   LIG    1       -1.759   0.556   0.404  0.00  0.00    +0.176 C 
ATOM     20  C   LIG    1       -2.415  -0.365  -0.627  0.00  0.00    +0.044 C 
ATOM     21  C   LIG    1       -3.684   0.279  -1.159  0.00  0.00    +0.099 C 
ENDBRANCH   1  19
TORSDOF 1