REMARK  Name = BDB064714
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.440   0.703   0.944  0.00  0.00    +0.147 A 
ATOM      2  C   LIG    1       -3.128   0.777   0.448  0.00  0.00    +0.147 A 
ATOM      3  N   LIG    1       -2.298   1.841   0.152  0.00  0.00    -0.231 NA
ATOM      4  C   LIG    1       -1.182   1.288  -0.277  0.00  0.00    +0.201 A 
ATOM      5  N   LIG    1       -1.263  -0.079  -0.286  0.00  0.00    -0.312 N 
ATOM      6  C   LIG    1       -2.502  -0.427   0.171  0.00  0.00    +0.165 A 
ATOM      7  N   LIG    1       -3.005  -1.664   0.322  0.00  0.00    -0.216 NA
ATOM      8  C   LIG    1       -4.268  -1.608   0.792  0.00  0.00    +0.225 A 
ATOM      9  N   LIG    1       -5.005  -0.517   1.098  0.00  0.00    -0.219 NA
ENDROOT
BRANCH   1  10
ATOM     10  N   LIG    1       -5.196   1.823   1.267  0.00  0.00    -0.341 N 
ATOM     11  H   LIG    1       -6.189   1.633   1.245  0.00  0.00    +0.144 HD
ATOM     12  H   LIG    1       -4.865   2.673   0.824  0.00  0.00    +0.144 HD
ENDBRANCH   1  10
BRANCH   5  13
ATOM     13  C   LIG    1       -0.229  -0.996  -0.720  0.00  0.00    +0.165 C 
BRANCH  13  14
ATOM     14  C   LIG    1        0.625  -1.492   0.444  0.00  0.00    +0.250 C 
BRANCH  14  15
ATOM     15  O   LIG    1        1.438  -0.443   0.979  0.00  0.00    -0.490 OA
BRANCH  15  16
ATOM     16  C   LIG    1        2.635  -0.154   0.391  0.00  0.00    +0.123 A 
ATOM     17  C   LIG    1        3.198  -0.803  -0.706  0.00  0.00    +0.085 A 
ATOM     18  C   LIG    1        4.435  -0.383  -1.197  0.00  0.00    +0.141 A 
ATOM     19  F   LIG    1        4.950  -1.026  -2.256  0.00  0.00    -0.204 F 
ATOM     20  C   LIG    1        5.120   0.677  -0.607  0.00  0.00    +0.053 A 
ATOM     21 BR   LIG    1        6.793   1.240  -1.280  0.00  0.00    -0.047 Br
ATOM     22  C   LIG    1        4.563   1.329   0.489  0.00  0.00    +0.022 A 
ATOM     23  C   LIG    1        3.324   0.911   0.983  0.00  0.00    +0.047 A 
ENDBRANCH  15  16
ENDBRANCH  14  15
ENDBRANCH  13  14
ENDBRANCH   5  13
TORSDOF 5