REMARK  Name = BDB062847
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.312  -0.925  -0.114  0.00  0.00    +0.066 C 
ATOM      2  C   LIG    1        1.924  -0.362  -0.043  0.00  0.00    +0.042 A 
ATOM      3  N   LIG    1        0.895  -1.231  -0.168  0.00  0.00    -0.252 NA
ATOM      4  C   LIG    1       -0.362  -0.765  -0.103  0.00  0.00    +0.075 A 
ATOM      5  C   LIG    1       -0.668   0.602   0.086  0.00  0.00    +0.045 A 
ATOM      6  C   LIG    1       -2.026   0.997   0.157  0.00  0.00    +0.052 A 
ATOM      7  C   LIG    1       -3.038   0.053   0.030  0.00  0.00    +0.124 A 
ATOM      8  C   LIG    1       -2.741  -1.284  -0.163  0.00  0.00    +0.040 A 
ATOM      9  F   LIG    1       -4.317   0.445   0.099  0.00  0.00    -0.205 F 
ATOM     10  C   LIG    1        0.432   1.474   0.198  0.00  0.00    +0.128 A 
ATOM     11  C   LIG    1       -1.403  -1.678  -0.226  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1        1.733   0.995   0.142  0.00  0.00    +0.069 A 
ENDROOT
BRANCH  10  13
ATOM     13  O   LIG    1        0.317   2.829   0.365  0.00  0.00    -0.506 OA
ATOM     14  H   LIG    1       -0.601   3.103   0.219  0.00  0.00    +0.292 HD
ENDBRANCH  10  13
TORSDOF 1