REMARK  Name = BDB009157
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.618   1.728   1.115  0.00  0.00    -0.043 A 
ATOM      2  C   LIG    1        1.469   0.901   0.357  0.00  0.00    +0.015 A 
ATOM      3  C   LIG    1        2.658   1.386  -0.223  0.00  0.00    +0.018 A 
ATOM      4  C   LIG    1        2.966   2.739  -0.018  0.00  0.00    +0.131 A 
ATOM      5  F   LIG    1        4.087   3.265  -0.534  0.00  0.00    -0.205 F 
ATOM      6  C   LIG    1        2.137   3.575   0.727  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1        0.967   3.074   1.290  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   3   8
ATOM      8  C   LIG    1        3.529   0.496  -1.015  0.00  0.00    -0.014 A 
ATOM      9  C   LIG    1        3.886  -0.778  -0.541  0.00  0.00    +0.021 A 
ATOM     10  C   LIG    1        4.708  -1.632  -1.292  0.00  0.00    +0.037 A 
ATOM     11  C   LIG    1        5.173  -1.224  -2.546  0.00  0.00    +0.013 A 
ATOM     12  C   LIG    1        4.832   0.037  -3.032  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        4.021   0.886  -2.273  0.00  0.00    +0.008 A 
BRANCH  10  14
ATOM     14  C   LIG    1        5.033  -2.968  -0.729  0.00  0.00    +0.242 C 
ATOM     15  O   LIG    1        4.323  -3.499   0.116  0.00  0.00    -0.270 OA
ATOM     16  N   LIG    1        6.181  -3.572  -1.163  0.00  0.00    -0.325 N 
ATOM     17  H   LIG    1        6.918  -3.050  -1.614  0.00  0.00    +0.145 HD
ATOM     18  H   LIG    1        6.448  -4.412  -0.665  0.00  0.00    +0.145 HD
ENDBRANCH  10  14
ENDBRANCH   3   8
BRANCH   1  20
ATOM     19  C   LIG    1       -0.669   1.294   3.235  0.00  0.00    +0.013 C 
ATOM     20  C   LIG    1       -0.660   1.151   1.708  0.00  0.00    +0.022 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -1.891   1.803   1.053  0.00  0.00    +0.065 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -3.145   0.962   1.251  0.00  0.00    +0.066 A 
ATOM     23  C   LIG    1       -3.489  -0.094   0.249  0.00  0.00    -0.016 A 
ATOM     24  C   LIG    1       -2.612  -0.343  -0.946  0.00  0.00    +0.037 C 
ATOM     25  C   LIG    1       -2.928  -1.656  -1.668  0.00  0.00    +0.005 C 
ATOM     26  C   LIG    1       -4.432  -1.855  -1.814  0.00  0.00    +0.005 C 
ATOM     27  C   LIG    1       -5.119  -1.869  -0.447  0.00  0.00    +0.041 C 
ATOM     28  C   LIG    1       -4.612  -0.798   0.477  0.00  0.00    +0.023 A 
ATOM     29  C   LIG    1       -5.429  -0.524   1.686  0.00  0.00    +0.268 A 
ATOM     30  O   LIG    1       -6.449  -1.158   1.934  0.00  0.00    -0.266 OA
ATOM     31  N   LIG    1       -4.973   0.474   2.504  0.00  0.00    -0.243 N 
ATOM     32  H   LIG    1       -5.517   0.678   3.335  0.00  0.00    +0.192 HD
ATOM     33  N   LIG    1       -3.853   1.220   2.308  0.00  0.00    -0.176 NA
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   1  20
TORSDOF 5