REMARK  Name = BDB063794
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.309  -2.359   0.364  0.00  0.00    +0.110 C 
ATOM      2  N   LIG    1       -0.370  -0.925  -0.118  0.00  0.00    -0.378 NA
ATOM      3  C   LIG    1       -1.714  -0.348   0.129  0.00  0.00    +0.023 A 
ATOM      4  C   LIG    1       -1.623   0.922   0.718  0.00  0.00    -0.022 A 
ATOM      5  C   LIG    1       -2.760   1.663   1.014  0.00  0.00    +0.055 A 
ATOM      6  C   LIG    1       -3.968   1.071   0.705  0.00  0.00    +0.167 A 
ATOM      7  O   LIG    1       -5.192   1.622   0.913  0.00  0.00    -0.453 OA
ATOM      8  C   LIG    1       -6.060   0.586   0.404  0.00  0.00    +0.466 C 
ATOM      9  O   LIG    1       -5.336  -0.559  -0.103  0.00  0.00    -0.453 OA
ATOM     10  C   LIG    1       -4.050  -0.180   0.122  0.00  0.00    +0.168 A 
ATOM     11  C   LIG    1       -0.202   1.338   0.893  0.00  0.00    +0.063 C 
ATOM     12  C   LIG    1       -2.932  -0.928  -0.191  0.00  0.00    +0.071 A 
ATOM     13  C   LIG    1        0.549  -0.007   0.761  0.00  0.00    +0.093 C 
ATOM     14  C   LIG    1        1.968   0.140   0.264  0.00  0.00    -0.021 A 
ATOM     15  C   LIG    1        2.377  -0.368  -0.986  0.00  0.00    -0.037 A 
ATOM     16  C   LIG    1        3.715  -0.233  -1.391  0.00  0.00    +0.053 A 
ATOM     17  C   LIG    1        4.627   0.414  -0.569  0.00  0.00    +0.158 A 
ATOM     18  C   LIG    1        4.220   0.953   0.642  0.00  0.00    +0.159 A 
ATOM     19  C   LIG    1        1.419  -1.111  -1.881  0.00  0.00    +0.053 C 
ATOM     20  C   LIG    1        2.908   0.804   1.073  0.00  0.00    +0.055 A 
ATOM     21  C   LIG    1       -0.041  -0.766  -1.599  0.00  0.00    +0.092 C 
ENDROOT
BRANCH  18  22
ATOM     22  O   LIG    1        5.082   1.657   1.428  0.00  0.00    -0.503 OA
ATOM     23  H   LIG    1        5.712   2.107   0.834  0.00  0.00    +0.292 HD
ENDBRANCH  18  22
BRANCH  17  24
ATOM     24  O   LIG    1        5.928   0.484  -0.968  0.00  0.00    -0.503 OA
ATOM     25  H   LIG    1        6.482   0.364  -0.174  0.00  0.00    +0.292 HD
ENDBRANCH  17  24
TORSDOF 2