REMARK  Name = BDB064440
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.516   1.253   0.220  0.00  0.00    +0.196 C 
ATOM      2  O   LIG    1        0.599   2.467   0.383  0.00  0.00    -0.287 OA
ENDROOT
BRANCH   1   8
ATOM      3  C   LIG    1        5.202  -1.968  -0.702  0.00  0.00    +0.086 C 
ATOM      4  C   LIG    1        4.005  -1.090  -0.535  0.00  0.00    +0.110 A 
ATOM      5  O   LIG    1        3.146  -1.472   0.521  0.00  0.00    -0.427 OA
ATOM      6  C   LIG    1        2.000  -0.773   0.797  0.00  0.00    +0.351 A 
ATOM      7  O   LIG    1        1.247  -1.128   1.699  0.00  0.00    -0.244 OA
ATOM      8  C   LIG    1        1.706   0.407  -0.041  0.00  0.00    +0.147 A 
ATOM      9  C   LIG    1        2.542   0.738  -1.039  0.00  0.00    +0.138 A 
ATOM     10  C   LIG    1        3.729  -0.029  -1.302  0.00  0.00    +0.087 A 
BRANCH   9  11
ATOM     11  O   LIG    1        2.307   1.793  -1.891  0.00  0.00    -0.506 OA
ATOM     12  H   LIG    1        3.125   2.041  -2.354  0.00  0.00    +0.292 HD
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   1  13
ATOM     13  C   LIG    1       -0.789   0.536   0.280  0.00  0.00    +0.052 C 
ATOM     14  C   LIG    1       -1.916   1.222   0.525  0.00  0.00    +0.012 C 
BRANCH  14  15
ATOM     15  C   LIG    1       -3.242   0.599   0.610  0.00  0.00    -0.019 A 
ATOM     16  C   LIG    1       -4.344   1.273   0.087  0.00  0.00    +0.067 A 
ATOM     17  C   LIG    1       -5.591   0.682   0.195  0.00  0.00    +0.214 A 
ATOM     18  F   LIG    1       -6.648   1.326  -0.319  0.00  0.00    -0.184 F 
ATOM     19  N   LIG    1       -5.817  -0.508   0.788  0.00  0.00    -0.228 NA
ATOM     20  C   LIG    1       -4.740  -1.133   1.306  0.00  0.00    +0.114 A 
ATOM     21  C   LIG    1       -3.450  -0.627   1.246  0.00  0.00    +0.028 A 
ENDBRANCH  14  15
ENDBRANCH   1  13
TORSDOF 4