REMARK  Name = BDB003608
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.968  -0.612  -0.591  0.00  0.00    +0.352 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        2.258  -0.059  -0.024  0.00  0.00    +0.343 C 
ATOM      3  O   LIG    1        3.363  -0.152  -0.536  0.00  0.00    -0.247 OA
BRANCH   2   4
ATOM      4  O   LIG    1        2.120   0.530   1.182  0.00  0.00    -0.478 OA
ATOM      5  H   LIG    1        3.027   0.817   1.416  0.00  0.00    +0.295 HD
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1   6
ATOM      6  O   LIG    1       -0.145   0.218  -0.254  0.00  0.00    -0.453 OA
BRANCH   6   8
ATOM      7  C   LIG    1       -2.452   0.628  -0.228  0.00  0.00    +0.136 C 
ATOM      8  C   LIG    1       -1.344  -0.295  -0.634  0.00  0.00    +0.304 C 
ATOM      9  O   LIG    1       -1.504  -1.353  -1.225  0.00  0.00    -0.251 OA
ENDBRANCH   6   8
ENDBRANCH   1   6
TORSDOF 4