REMARK  Name = BDB000840
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.689  -0.743   0.094  0.00  0.00    +0.158 A 
ATOM      2  C   LIG    1       -0.790   0.642  -0.003  0.00  0.00    +0.158 A 
ATOM      3  C   LIG    1        0.347   1.423  -0.152  0.00  0.00    +0.049 A 
ATOM      4  C   LIG    1        1.600   0.807  -0.168  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1        1.703  -0.581  -0.036  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1        0.553  -1.362   0.096  0.00  0.00    +0.049 A 
ENDROOT
BRANCH   1   7
ATOM      7  O   LIG    1       -1.813  -1.516   0.157  0.00  0.00    -0.503 OA
ATOM      8  H   LIG    1       -2.461  -1.089  -0.433  0.00  0.00    +0.292 HD
ENDBRANCH   1   7
BRANCH   2   9
ATOM      9  O   LIG    1       -2.007   1.255   0.079  0.00  0.00    -0.503 OA
ATOM     10  H   LIG    1       -2.515   0.749   0.740  0.00  0.00    +0.292 HD
ENDBRANCH   2   9
TORSDOF 2