REMARK  Name = BDB048416
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.871   0.701   1.066  0.00  0.00    +0.162 A 
ATOM      2  C   LIG    1       -3.206  -0.065   0.089  0.00  0.00    +0.171 A 
ATOM      3  C   LIG    1       -1.788  -0.057   0.013  0.00  0.00    +0.044 A 
ATOM      4  C   LIG    1       -1.044   0.672   0.951  0.00  0.00    -0.011 A 
ATOM      5  C   LIG    1        0.353   0.663   0.875  0.00  0.00    +0.035 A 
ATOM      6  C   LIG    1        1.013  -0.063  -0.127  0.00  0.00    +0.050 A 
ATOM      7  C   LIG    1        2.481  -0.109  -0.291  0.00  0.00    +0.005 A 
ATOM      8  C   LIG    1        3.041  -0.451  -1.556  0.00  0.00    -0.033 A 
ATOM      9  C   LIG    1        4.429  -0.452  -1.772  0.00  0.00    +0.054 A 
ATOM     10  C   LIG    1        5.242  -0.144  -0.707  0.00  0.00    +0.167 A 
ATOM     11  O   LIG    1        6.599  -0.107  -0.726  0.00  0.00    -0.453 OA
ATOM     12  C   LIG    1        6.885   0.263   0.640  0.00  0.00    +0.466 C 
ATOM     13  O   LIG    1        5.693   0.428   1.441  0.00  0.00    -0.453 OA
ATOM     14  C   LIG    1        4.726   0.162   0.525  0.00  0.00    +0.167 A 
ATOM     15  C   LIG    1        2.104  -0.791  -2.682  0.00  0.00    +0.057 C 
ATOM     16  C   LIG    1        0.918  -1.548  -2.112  0.00  0.00    +0.126 C 
ATOM     17  C   LIG    1        3.365   0.187   0.764  0.00  0.00    +0.059 A 
ATOM     18  N   LIG    1        0.269  -0.747  -1.041  0.00  0.00    -0.346 N 
ATOM     19  C   LIG    1       -1.713   1.398   1.942  0.00  0.00    +0.012 A 
ATOM     20  C   LIG    1       -1.084  -0.758  -0.971  0.00  0.00    +0.098 A 
ATOM     21  C   LIG    1       -3.110   1.416   1.995  0.00  0.00    +0.050 A 
ENDROOT
BRANCH   1  23
ATOM     22  C   LIG    1       -5.924   1.558   1.963  0.00  0.00    +0.277 C 
ATOM     23  O   LIG    1       -5.238   0.726   1.034  0.00  0.00    -0.491 OA
ENDBRANCH   1  23
BRANCH   2  24
ATOM     24  O   LIG    1       -3.819  -0.819  -0.888  0.00  0.00    -0.491 OA
ATOM     25  C   LIG    1       -5.045  -1.459  -0.535  0.00  0.00    +0.277 C 
ENDBRANCH   2  24
TORSDOF 2