REMARK  Name = BDB047737
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.826  -0.730  -0.589  0.00  0.00    +0.000 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.372  -0.514  -0.162  0.00  0.00    +0.000 C 
BRANCH   2   3
ATOM      3  C   LIG    1        0.600  -1.006  -1.237  0.00  0.00    +0.000 C 
BRANCH   3   4
ATOM      4  C   LIG    1        2.070  -0.915  -0.815  0.00  0.00    -0.000 C 
BRANCH   4   5
ATOM      5  C   LIG    1        2.553   0.523  -0.610  0.00  0.00    -0.000 C 
BRANCH   5   6
ATOM      6  C   LIG    1        4.068   0.630  -0.410  0.00  0.00    -0.000 C 
BRANCH   6   8
ATOM      7  C   LIG    1        6.048   0.192   1.085  0.00  0.00    +0.004 C 
ATOM      8  C   LIG    1        4.559  -0.036   0.876  0.00  0.00    -0.003 C 
ENDBRANCH   6   8
ENDBRANCH   5   6
ENDBRANCH   4   5
ENDBRANCH   3   4
ENDBRANCH   2   3
ENDBRANCH   1   2
BRANCH   1   9
ATOM      9  C   LIG    1       -2.800  -0.235   0.482  0.00  0.00    +0.001 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -4.254  -0.455   0.054  0.00  0.00    +0.011 C 
BRANCH  10  11
ATOM     11  C   LIG    1       -5.252   0.007   1.116  0.00  0.00    +0.120 C 
BRANCH  11  12
ATOM     12  C   LIG    1       -5.346   1.506   1.221  0.00  0.00    +0.305 C 
ATOM     13  O   LIG    1       -4.917   2.336   0.438  0.00  0.00    -0.251 OA
BRANCH  12  14
ATOM     14  O   LIG    1       -6.021   1.890   2.322  0.00  0.00    -0.481 OA
ATOM     15  H   LIG    1       -6.026   2.868   2.267  0.00  0.00    +0.295 HD
ENDBRANCH  12  14
ENDBRANCH  11  12
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   1   9
TORSDOF 11