REMARK  Name = BDB009442
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.937   0.911  -0.029  0.00  0.00    +0.081 A 
ATOM      2  C   LIG    1       -0.995   2.277   0.283  0.00  0.00    +0.145 A 
ATOM      3  F   LIG    1       -1.973   3.058  -0.197  0.00  0.00    -0.204 F 
ATOM      4  C   LIG    1       -0.107   2.860   1.186  0.00  0.00    +0.040 A 
ATOM      5  C   LIG    1        0.870   2.085   1.805  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        0.963   0.718   1.522  0.00  0.00    -0.040 A 
ATOM      7  C   LIG    1        0.040   0.141   0.626  0.00  0.00    +0.031 A 
ENDROOT
BRANCH   1  10
ATOM      8  O   LIG    1       -2.098   2.064  -2.522  0.00  0.00    -0.252 OA
ATOM      9  C   LIG    1       -2.372   0.973  -2.047  0.00  0.00    +0.314 C 
ATOM     10  N   LIG    1       -1.840   0.325  -0.954  0.00  0.00    -0.190 N 
ATOM     11  C   LIG    1       -2.223  -1.000  -0.976  0.00  0.00    +0.248 C 
ATOM     12  O   LIG    1       -1.892  -1.909  -0.224  0.00  0.00    -0.273 OA
ATOM     13  C   LIG    1       -3.188  -1.205  -2.141  0.00  0.00    +0.166 C 
ATOM     14  N   LIG    1       -3.243   0.118  -2.693  0.00  0.00    -0.287 N 
ATOM     15  H   LIG    1       -3.582   0.365  -3.613  0.00  0.00    +0.151 HD
BRANCH  13  16
ATOM     16  C   LIG    1       -4.542  -1.772  -1.711  0.00  0.00    +0.067 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -5.266  -0.963  -0.659  0.00  0.00    -0.045 A 
ATOM     18  C   LIG    1       -6.082   0.117  -1.023  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1       -6.725   0.879  -0.047  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -6.561   0.569   1.302  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -5.754  -0.502   1.676  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -5.109  -1.266   0.701  0.00  0.00    +0.004 A 
ENDBRANCH  16  17
ENDBRANCH  13  16
ENDBRANCH   1  10
BRANCH   6  23
ATOM     23  C   LIG    1        2.013  -0.131   2.207  0.00  0.00    +0.092 C 
BRANCH  23  24
ATOM     24  C   LIG    1        2.856  -0.962   1.244  0.00  0.00    +0.069 A 
ATOM     25  C   LIG    1        4.039  -0.343   0.567  0.00  0.00    -0.016 A 
ATOM     26  C   LIG    1        4.405   1.094   0.809  0.00  0.00    +0.037 C 
ATOM     27  C   LIG    1        5.444   1.635  -0.179  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1        6.556   0.623  -0.421  0.00  0.00    +0.005 C 
ATOM     29  C   LIG    1        5.991  -0.688  -0.972  0.00  0.00    +0.041 C 
ATOM     30  C   LIG    1        4.749  -1.138  -0.254  0.00  0.00    +0.023 A 
ATOM     31  C   LIG    1        4.329  -2.543  -0.479  0.00  0.00    +0.268 A 
ATOM     32  O   LIG    1        4.938  -3.287  -1.241  0.00  0.00    -0.266 OA
ATOM     33  N   LIG    1        3.223  -2.955   0.213  0.00  0.00    -0.243 N 
ATOM     34  H   LIG    1        2.917  -3.912   0.075  0.00  0.00    +0.192 HD
ATOM     35  N   LIG    1        2.487  -2.197   1.067  0.00  0.00    -0.175 NA
ENDBRANCH  23  24
ENDBRANCH   6  23
TORSDOF 5