REMARK  Name = BDB000569
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.147   0.120   0.016  0.00  0.00    +0.059 A 
ATOM      2  C   LIG    1        2.809  -0.053   1.364  0.00  0.00    +0.015 A 
ATOM      3  C   LIG    1        1.494  -0.367   1.721  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1        0.507  -0.497   0.736  0.00  0.00    +0.022 A 
ATOM      5  C   LIG    1        0.847  -0.345  -0.614  0.00  0.00    +0.012 A 
ATOM      6  C   LIG    1        2.162  -0.031  -0.971  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        4.892   0.619  -1.563  0.00  0.00    -0.245 OA
ATOM      8  C   LIG    1        4.526   0.453  -0.415  0.00  0.00    +0.337 C 
BRANCH   8   9
ATOM      9  O   LIG    1        5.382   0.566   0.616  0.00  0.00    -0.477 OA
ATOM     10  H   LIG    1        6.239   0.780   0.191  0.00  0.00    +0.295 HD
ENDBRANCH   8   9
ENDBRANCH   1   8
BRANCH   4  11
ATOM     11  C   LIG    1       -0.872  -0.848   1.160  0.00  0.00    +0.193 C 
ATOM     12  O   LIG    1       -1.029  -1.578   2.136  0.00  0.00    -0.287 OA
BRANCH  11  13
ATOM     13  C   LIG    1       -2.063  -0.341   0.433  0.00  0.00    +0.022 A 
ATOM     14  C   LIG    1       -3.190  -1.167   0.343  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1       -4.332  -0.721  -0.325  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -4.355   0.554  -0.890  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -3.242   1.388  -0.783  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1       -2.097   0.946  -0.117  0.00  0.00    +0.012 A 
ENDBRANCH  11  13
ENDBRANCH   4  11
TORSDOF 4