REMARK  Name = BDB009135
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.601  -0.866   0.048  0.00  0.00    +0.018 A 
ATOM      2  C   LIG    1        2.237  -2.151   0.477  0.00  0.00    +0.131 A 
ATOM      3  F   LIG    1        3.160  -2.982   0.987  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.925  -2.611   0.385  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -0.065  -1.789  -0.147  0.00  0.00    +0.006 A 
ATOM      6  C   LIG    1        0.256  -0.500  -0.589  0.00  0.00    -0.046 A 
ATOM      7  C   LIG    1        1.584  -0.051  -0.484  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  10
ATOM      8  C   LIG    1        5.937   0.710  -0.862  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1        4.620   0.235  -0.952  0.00  0.00    +0.021 A 
ATOM     10  C   LIG    1        3.988  -0.373   0.147  0.00  0.00    -0.014 A 
ATOM     11  C   LIG    1        4.718  -0.485   1.343  0.00  0.00    +0.008 A 
ATOM     12  C   LIG    1        6.026  -0.002   1.443  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        6.636   0.599   0.344  0.00  0.00    +0.013 A 
BRANCH   8  17
ATOM     14  N   LIG    1        7.902   1.349  -2.160  0.00  0.00    -0.325 N 
ATOM     15  H   LIG    1        8.475   0.724  -1.611  0.00  0.00    +0.145 HD
ATOM     16  H   LIG    1        8.277   1.661  -3.047  0.00  0.00    +0.145 HD
ATOM     17  C   LIG    1        6.537   1.345  -2.065  0.00  0.00    +0.242 C 
ATOM     18  O   LIG    1        5.845   1.817  -2.958  0.00  0.00    -0.270 OA
ENDBRANCH   8  17
ENDBRANCH   1  10
BRANCH   6  19
ATOM     19  C   LIG    1       -0.812   0.408  -1.151  0.00  0.00    +0.041 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -1.381   1.389  -0.125  0.00  0.00    +0.062 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -2.386   0.718   0.803  0.00  0.00    +0.065 A 
ATOM     22  C   LIG    1       -3.828   0.655   0.409  0.00  0.00    -0.016 A 
ATOM     23  C   LIG    1       -4.305   1.257  -0.883  0.00  0.00    +0.037 C 
ATOM     24  C   LIG    1       -5.721   0.819  -1.271  0.00  0.00    +0.005 C 
ATOM     25  C   LIG    1       -6.655   0.847  -0.068  0.00  0.00    +0.005 C 
ATOM     26  C   LIG    1       -6.145  -0.072   1.044  0.00  0.00    +0.041 C 
ATOM     27  C   LIG    1       -4.662   0.044   1.268  0.00  0.00    +0.023 A 
ATOM     28  C   LIG    1       -4.136  -0.546   2.525  0.00  0.00    +0.268 A 
ATOM     29  O   LIG    1       -4.865  -1.135   3.317  0.00  0.00    -0.266 OA
ATOM     30  N   LIG    1       -2.794  -0.392   2.742  0.00  0.00    -0.243 N 
ATOM     31  H   LIG    1       -2.411  -0.784   3.595  0.00  0.00    +0.192 HD
ATOM     32  N   LIG    1       -1.916   0.224   1.908  0.00  0.00    -0.176 NA
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH   6  19
TORSDOF 5