REMARK  Name = BDB047907
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.282  -1.692   0.222  0.00  0.00    +0.224 A 
ATOM      2  C   LIG    1        2.210  -0.651   0.263  0.00  0.00    +0.062 A 
ATOM      3  C   LIG    1        1.634   0.622   0.203  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1        2.472   1.730   0.247  0.00  0.00    +0.028 A 
ATOM      5  C   LIG    1        3.861   1.604   0.339  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        4.439   0.342   0.383  0.00  0.00    +0.001 A 
ATOM      7  N   LIG    1        0.315   0.817   0.102  0.00  0.00    -0.227 NA
ATOM      8  C   LIG    1       -0.481  -0.268   0.046  0.00  0.00    +0.164 A 
ATOM      9  C   LIG    1        3.622  -0.785   0.343  0.00  0.00    +0.015 A 
ATOM     10  N   LIG    1       -0.041  -1.532   0.105  0.00  0.00    -0.193 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1       -1.938  -0.050  -0.079  0.00  0.00    +0.019 A 
ATOM     12  C   LIG    1       -2.487   1.250  -0.133  0.00  0.00    +0.014 A 
ATOM     13  C   LIG    1       -3.865   1.457  -0.251  0.00  0.00    +0.039 A 
ATOM     14  C   LIG    1       -4.718   0.364  -0.319  0.00  0.00    +0.123 A 
ATOM     15  F   LIG    1       -6.038   0.561  -0.432  0.00  0.00    -0.205 F 
ATOM     16  C   LIG    1       -4.219  -0.929  -0.270  0.00  0.00    +0.039 A 
ATOM     17  C   LIG    1       -2.841  -1.132  -0.151  0.00  0.00    +0.014 A 
ENDBRANCH   8  11
BRANCH   1  18
ATOM     18  O   LIG    1        1.655  -3.005   0.308  0.00  0.00    -0.492 OA
ATOM     19  H   LIG    1        2.481  -3.047   0.810  0.00  0.00    +0.294 HD
ENDBRANCH   1  18
TORSDOF 2