REMARK  Name = BDB000556
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.039  -0.185   0.604  0.00  0.00    +0.233 C 
ATOM      2  O   LIG    1       -0.524  -0.596   1.653  0.00  0.00    -0.283 OA
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.448   0.021   0.565  0.00  0.00    +0.026 A 
ATOM      4  C   LIG    1        2.165  -0.276   1.743  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1        3.554  -0.118   1.813  0.00  0.00    +0.033 A 
ATOM      6  C   LIG    1        4.249   0.344   0.693  0.00  0.00    +0.126 A 
ATOM      7  C   LIG    1        3.560   0.645  -0.487  0.00  0.00    +0.033 A 
ATOM      8  C   LIG    1        2.167   0.483  -0.545  0.00  0.00    +0.014 A 
BRANCH   6   9
ATOM      9  N   LIG    1        5.707   0.513   0.753  0.00  0.00    +0.056 N 
ATOM     10  O   LIG    1        6.281   0.925  -0.264  0.00  0.00    -0.126 OA
ATOM     11  O   LIG    1        6.275   0.234   1.818  0.00  0.00    -0.126 OA
ENDBRANCH   6   9
ENDBRANCH   1   3
BRANCH   1  13
ATOM     12  O   LIG    1       -0.462   0.503  -1.638  0.00  0.00    -0.283 OA
ATOM     13  C   LIG    1       -0.957   0.092  -0.592  0.00  0.00    +0.233 C 
BRANCH  13  14
ATOM     14  C   LIG    1       -2.442  -0.113  -0.555  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1       -3.158   0.183  -1.731  0.00  0.00    +0.012 A 
ATOM     16  C   LIG    1       -4.545   0.024  -1.794  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1       -5.241  -0.435  -0.682  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1       -4.550  -0.734   0.489  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -3.160  -0.574   0.554  0.00  0.00    +0.012 A 
ENDBRANCH  13  14
ENDBRANCH   1  13
TORSDOF 4