REMARK  Name = BDB063092
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.718  -1.282   0.038  0.00  0.00    -0.014 C 
ATOM      2  C   LIG    1       -0.577  -0.943  -0.070  0.00  0.00    +0.064 C 
ATOM      3  C   LIG    1       -1.249   0.359   0.144  0.00  0.00    +0.191 C 
ATOM      4  C   LIG    1       -2.475   0.184  -0.745  0.00  0.00    +0.207 C 
ATOM      5  C   LIG    1       -3.713   0.936  -0.287  0.00  0.00    +0.055 C 
ATOM      6  O   LIG    1       -2.759  -1.222  -0.757  0.00  0.00    -0.455 OA
ATOM      7  C   LIG    1       -1.610  -1.911  -0.507  0.00  0.00    +0.338 C 
ATOM      8  O   LIG    1       -1.466  -3.113  -0.637  0.00  0.00    -0.245 OA
ENDROOT
BRANCH   3   9
ATOM      9  O   LIG    1       -1.555   0.475   1.528  0.00  0.00    -0.383 OA
ATOM     10  H   LIG    1       -1.931   1.358   1.681  0.00  0.00    +0.210 HD
ENDBRANCH   3   9
BRANCH   1  11
ATOM     11  C   LIG    1        1.825  -0.370   0.480  0.00  0.00    +0.027 C 
BRANCH  11  13
ATOM     12  C   LIG    1        3.951   0.795  -0.208  0.00  0.00    +0.004 C 
ATOM     13  C   LIG    1        2.817  -0.115  -0.654  0.00  0.00    +0.001 C 
ENDBRANCH  11  13
ENDBRANCH   1  11
TORSDOF 3