REMARK  Name = BDB048292
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.466  -2.817   1.263  0.00  0.00    -0.246 OA
ATOM      2  C   LIG    1       -1.143  -1.912   0.796  0.00  0.00    +0.334 A 
ATOM      3  N   LIG    1       -0.713  -0.669   0.293  0.00  0.00    -0.230 N 
ATOM      4  C   LIG    1       -1.823   0.065  -0.143  0.00  0.00    +0.081 A 
ATOM      5  C   LIG    1       -2.955  -0.727   0.089  0.00  0.00    +0.109 A 
ATOM      6  C   LIG    1       -4.222  -0.291  -0.232  0.00  0.00    +0.142 A 
ATOM      7  C   LIG    1       -4.353   0.973  -0.801  0.00  0.00    +0.047 A 
ATOM      8  C   LIG    1       -3.217   1.774  -1.038  0.00  0.00    +0.006 A 
ATOM      9  C   LIG    1       -1.934   1.321  -0.707  0.00  0.00    +0.029 A 
ATOM     10  N   LIG    1       -2.543  -1.933   0.662  0.00  0.00    -0.303 N 
ATOM     11  H   LIG    1       -3.106  -2.716   0.949  0.00  0.00    +0.171 HD
ENDROOT
BRANCH   3  12
ATOM     12  C   LIG    1        0.593  -0.257   0.245  0.00  0.00    +0.218 A 
ATOM     13  N   LIG    1        1.614  -1.058   0.702  0.00  0.00    -0.323 N 
ATOM     14  H   LIG    1        1.481  -1.981   1.095  0.00  0.00    +0.169 HD
ATOM     15  C   LIG    1        2.801  -0.399   0.533  0.00  0.00    +0.068 A 
ATOM     16  C   LIG    1        2.434   0.813  -0.037  0.00  0.00    +0.091 A 
ATOM     17  C   LIG    1        3.428   1.752  -0.349  0.00  0.00    +0.030 A 
ATOM     18  C   LIG    1        4.764   1.433  -0.071  0.00  0.00    +0.002 A 
ATOM     19  C   LIG    1        5.102   0.204   0.503  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1        4.123  -0.745   0.821  0.00  0.00    +0.028 A 
ATOM     21  N   LIG    1        1.073   0.884  -0.208  0.00  0.00    -0.212 NA
ENDBRANCH   3  12
BRANCH   6  22
ATOM     22  O   LIG    1       -5.344  -1.029  -0.022  0.00  0.00    -0.505 OA
ATOM     23  H   LIG    1       -5.082  -1.873   0.376  0.00  0.00    +0.292 HD
ENDBRANCH   6  22
TORSDOF 2