REMARK  Name = BDB062550
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.338  -2.365   0.200  0.00  0.00    -0.144 OA
ATOM      2  N   LIG    1       -0.567  -1.133   0.079  0.00  0.00    -0.042 N 
ATOM      3  N   LIG    1       -1.940  -0.610   0.095  0.00  0.00    -0.204 N 
ATOM      4  C   LIG    1       -1.868   0.779  -0.058  0.00  0.00    +0.158 A 
ATOM      5  C   LIG    1       -3.098   1.489  -0.070  0.00  0.00    +0.048 A 
ATOM      6  C   LIG    1       -4.257   0.814   0.064  0.00  0.00    +0.005 A 
ATOM      7  C   LIG    1       -4.289  -0.635   0.222  0.00  0.00    +0.020 A 
ATOM      8  N   LIG    1       -0.595   1.167  -0.168  0.00  0.00    -0.205 NA
ATOM      9  C   LIG    1       -3.131  -1.317   0.234  0.00  0.00    +0.116 A 
ATOM     10  C   LIG    1        0.196  -0.019  -0.082  0.00  0.00    +0.202 A 
ENDROOT
BRANCH  10  11
ATOM     11  C   LIG    1        1.651   0.019  -0.163  0.00  0.00    +0.023 A 
ATOM     12  C   LIG    1        2.284   1.264  -0.331  0.00  0.00    +0.014 A 
ATOM     13  C   LIG    1        3.676   1.361  -0.415  0.00  0.00    +0.039 A 
ATOM     14  C   LIG    1        4.446   0.209  -0.331  0.00  0.00    +0.123 A 
ATOM     15  F   LIG    1        5.779   0.297  -0.411  0.00  0.00    -0.205 F 
ATOM     16  C   LIG    1        3.848  -1.033  -0.166  0.00  0.00    +0.039 A 
ATOM     17  C   LIG    1        2.454  -1.129  -0.082  0.00  0.00    +0.014 A 
ENDBRANCH  10  11
TORSDOF 1