REMARK  Name = BDB000579
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.113  -0.127   0.337  0.00  0.00    +0.023 C 
ATOM      2  C   LIG    1       -1.004  -0.138  -0.705  0.00  0.00    +0.118 C 
ATOM      3  C   LIG    1       -0.093  -1.323  -0.472  0.00  0.00    +0.143 C 
ATOM      4  O   LIG    1       -0.366  -2.436  -0.926  0.00  0.00    -0.297 OA
ATOM      5  C   LIG    1        1.089  -1.138   0.451  0.00  0.00    +0.075 C 
ATOM      6  C   LIG    1        1.826   0.146   0.110  0.00  0.00    +0.015 C 
ATOM      7  C   LIG    1        0.904   1.347   0.229  0.00  0.00    +0.075 C 
ATOM      8  C   LIG    1       -0.280   1.191  -0.697  0.00  0.00    +0.143 C 
ATOM      9  O   LIG    1       -0.707   2.153  -1.337  0.00  0.00    -0.297 OA
ENDROOT
TORSDOF 0