REMARK  Name = BDB065211
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.993  -0.449   0.382  0.00  0.00    +0.122 A 
ATOM      2  C   LIG    1       -1.225   0.013   1.451  0.00  0.00    +0.046 A 
ATOM      3  C   LIG    1        0.162  -0.150   1.450  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1        0.803  -0.793   0.382  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1        0.019  -1.280  -0.674  0.00  0.00    +0.012 A 
ATOM      6  C   LIG    1       -1.371  -1.116  -0.672  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.263  -0.971   0.377  0.00  0.00    -0.010 A 
ATOM      8  C   LIG    1        3.148  -0.003  -0.180  0.00  0.00    -0.010 A 
ATOM      9  C   LIG    1        4.545  -0.250  -0.146  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1        5.438   0.689  -0.689  0.00  0.00    +0.008 A 
ATOM     11  C   LIG    1        4.976   1.870  -1.267  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        3.612   2.129  -1.309  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        5.032  -1.432   0.431  0.00  0.00    +0.008 A 
ATOM     14  C   LIG    1        4.162  -2.374   0.974  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1        2.712   1.206  -0.774  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1        2.791  -2.144   0.947  0.00  0.00    +0.009 A 
ENDBRANCH   4   7
BRANCH   1  17
ATOM     17  O   LIG    1       -3.340  -0.252   0.497  0.00  0.00    -0.478 OA
BRANCH  17  18
ATOM     18  C   LIG    1       -4.057   0.039  -0.707  0.00  0.00    +0.281 C 
BRANCH  18  20
ATOM     19  C   LIG    1       -3.922   2.542  -0.263  0.00  0.00    +0.008 C 
ATOM     20  C   LIG    1       -4.837   1.345  -0.486  0.00  0.00    +0.053 C 
ENDBRANCH  18  20
BRANCH  18  21
ATOM     21  C   LIG    1       -5.033  -1.095  -1.024  0.00  0.00    +0.346 C 
ATOM     22  O   LIG    1       -6.229  -0.995  -1.256  0.00  0.00    -0.247 OA
BRANCH  21  23
ATOM     23  O   LIG    1       -4.446  -2.309  -1.087  0.00  0.00    -0.478 OA
ATOM     24  H   LIG    1       -5.188  -2.924  -1.265  0.00  0.00    +0.295 HD
ENDBRANCH  21  23
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 6