REMARK  Name = BDB065311
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.037   0.240   0.290  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.132  -0.899   1.084  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        1.074  -1.000   2.033  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.749  -1.959   0.901  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.758  -1.867  -0.061  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.905  -0.703  -0.833  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.993   0.347  -0.655  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        0.365   2.463   0.759  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        0.924   1.396   0.500  0.00  0.00    +0.250 C 
ATOM     10  N   LIG    1        2.303   1.258   0.397  0.00  0.00    -0.290 N 
ATOM     11  C   LIG    1        3.014   0.111  -0.192  0.00  0.00    +0.110 C 
ATOM     12  C   LIG    1        4.295  -0.224   0.567  0.00  0.00    -0.024 A 
ATOM     13  C   LIG    1        4.844   0.664   1.515  0.00  0.00    -0.041 A 
ATOM     14  C   LIG    1        6.026   0.322   2.189  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1        6.673  -0.882   1.918  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        6.139  -1.762   0.981  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        4.133   1.946   1.874  0.00  0.00    +0.054 C 
ATOM     18  C   LIG    1        4.958  -1.438   0.313  0.00  0.00    +0.006 A 
ATOM     19  C   LIG    1        3.146   2.381   0.795  0.00  0.00    +0.113 C 
BRANCH  11  20
ATOM     20  C   LIG    1        3.357   0.428  -1.638  0.00  0.00    +0.014 C 
ATOM     21  C   LIG    1        3.327  -0.648  -2.701  0.00  0.00    +0.006 C 
ATOM     22  C   LIG    1        2.299   0.446  -2.717  0.00  0.00    +0.006 C 
ENDBRANCH  11  20
ENDBRANCH   1   9
BRANCH   6  23
ATOM     23  C   LIG    1       -3.008  -0.586  -1.861  0.00  0.00    +0.093 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -4.387  -0.936  -1.316  0.00  0.00    +0.074 A 
ATOM     25  C   LIG    1       -5.120   0.033  -0.460  0.00  0.00    +0.011 A 
ATOM     26  C   LIG    1       -6.370  -0.359   0.015  0.00  0.00    +0.050 A 
ATOM     27  C   LIG    1       -7.125   0.493   0.830  0.00  0.00    +0.014 A 
ATOM     28  C   LIG    1       -6.622   1.747   1.174  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1       -5.372   2.146   0.702  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1       -6.895  -1.684  -0.351  0.00  0.00    +0.272 A 
ATOM     31  O   LIG    1       -7.990  -2.070   0.041  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1       -6.088  -2.454  -1.152  0.00  0.00    -0.242 N 
ATOM     33  H   LIG    1       -6.436  -3.370  -1.416  0.00  0.00    +0.192 HD
ATOM     34  C   LIG    1       -4.621   1.294  -0.114  0.00  0.00    +0.010 A 
ATOM     35  N   LIG    1       -4.864  -2.106  -1.629  0.00  0.00    -0.175 NA
ENDBRANCH  23  24
ENDBRANCH   6  23
TORSDOF 4