REMARK  Name = BDB032832
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.635  -1.212   0.097  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -2.529  -2.006   0.382  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -2.355  -2.746   1.331  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.565  -1.811  -0.705  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -2.159  -1.000  -1.667  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1       -1.463  -0.651  -2.810  0.00  0.00    +0.006 A 
ATOM      7  C   LIG    1       -0.158  -1.135  -2.961  0.00  0.00    +0.007 A 
ATOM      8  C   LIG    1        0.438  -1.971  -1.986  0.00  0.00    -0.010 A 
ATOM      9  C   LIG    1       -0.282  -2.308  -0.831  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -3.551  -0.659  -1.255  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -5.512   2.487   2.301  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -5.407   1.310   1.967  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -6.173   0.800   0.950  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -6.816   1.451   0.521  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -5.982  -0.384   0.276  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -6.560  -0.584  -0.792  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -4.903  -1.330   0.828  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -4.764  -1.075   2.334  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -4.399   0.379   2.592  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   8  20
ATOM     20  C   LIG    1        1.855  -2.454  -2.165  0.00  0.00    +0.269 C 
BRANCH  20  21
ATOM     21  O   LIG    1        2.715  -1.473  -1.584  0.00  0.00    -0.445 OA
BRANCH  21  22
ATOM     22  C   LIG    1        4.031  -1.758  -1.691  0.00  0.00    +0.405 C 
ATOM     23  N   LIG    1        4.885  -0.841  -1.138  0.00  0.00    -0.251 N 
ATOM     24  H   LIG    1        5.848  -1.124  -1.267  0.00  0.00    +0.158 HD
ATOM     25  O   LIG    1        4.475  -2.760  -2.244  0.00  0.00    -0.226 OA
BRANCH  23  26
ATOM     26  C   LIG    1        4.664   0.367  -0.453  0.00  0.00    +0.037 A 
ATOM     27  C   LIG    1        5.804   1.063  -0.029  0.00  0.00    +0.027 A 
ATOM     28  C   LIG    1        5.702   2.277   0.664  0.00  0.00    +0.048 A 
ATOM     29  C   LIG    1        4.450   2.818   0.946  0.00  0.00    +0.130 A 
ATOM     30  C   LIG    1        3.312   2.127   0.526  0.00  0.00    +0.048 A 
ATOM     31  C   LIG    1        3.414   0.913  -0.167  0.00  0.00    +0.027 A 
BRANCH  29  32
ATOM     32  O   LIG    1        4.195   3.983   1.607  0.00  0.00    -0.406 OA
BRANCH  32  33
ATOM     33  C   LIG    1        5.302   4.739   2.065  0.00  0.00    +0.575 C 
ATOM     34  F   LIG    1        6.084   5.131   1.037  0.00  0.00    -0.133 F 
ATOM     35  F   LIG    1        4.843   5.847   2.689  0.00  0.00    -0.133 F 
ATOM     36  F   LIG    1        6.041   4.035   2.950  0.00  0.00    -0.133 F 
ENDBRANCH  32  33
ENDBRANCH  29  32
ENDBRANCH  23  26
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   8  20
TORSDOF 7