REMARK  Name = BDB013206
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.579  -0.129   0.199  0.00  0.00    +0.203 A 
ATOM      2  N   LIG    1        1.073  -0.392  -1.080  0.00  0.00    -0.253 N 
ATOM      3  C   LIG    1        2.413  -0.512  -1.362  0.00  0.00    +0.174 A 
ATOM      4  N   LIG    1        2.556  -0.739  -2.653  0.00  0.00    -0.129 NA
ATOM      5  N   LIG    1        1.304  -0.811  -3.218  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1        3.328  -0.380  -0.278  0.00  0.00    +0.065 A 
ATOM      7  C   LIG    1        2.760  -0.154   0.932  0.00  0.00    +0.128 A 
ATOM      8  C   LIG    1        0.427  -0.623  -2.258  0.00  0.00    +0.232 A 
ATOM      9  N   LIG    1        1.408  -0.032   1.200  0.00  0.00    -0.223 NA
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1        4.811  -0.476  -0.380  0.00  0.00    +0.094 A 
ATOM     11  N   LIG    1        5.532  -0.172   0.735  0.00  0.00    -0.252 NA
ATOM     12  C   LIG    1        6.880  -0.259   0.634  0.00  0.00    +0.131 A 
ATOM     13  C   LIG    1        7.513  -0.638  -0.533  0.00  0.00    +0.130 A 
ATOM     14  N   LIG    1        6.826  -0.947  -1.651  0.00  0.00    -0.260 NA
ATOM     15  C   LIG    1        5.472  -0.857  -1.549  0.00  0.00    +0.139 A 
ENDBRANCH   6  10
BRANCH   1  16
ATOM     16  N   LIG    1       -0.774   0.002   0.427  0.00  0.00    -0.310 N 
ATOM     17  H   LIG    1       -0.905  -0.026   1.440  0.00  0.00    +0.149 HD
BRANCH  16  18
ATOM     18  C   LIG    1       -1.467   1.193  -0.066  0.00  0.00    +0.143 C 
BRANCH  18  21
ATOM     19  F   LIG    1       -2.555   3.192   1.613  0.00  0.00    -0.205 F 
ATOM     20  C   LIG    1       -3.377   2.204   1.232  0.00  0.00    +0.129 A 
ATOM     21  C   LIG    1       -2.895   1.186   0.397  0.00  0.00    +0.012 A 
ATOM     22  C   LIG    1       -3.804   0.197   0.029  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1       -3.611  -1.031  -0.781  0.00  0.00    +0.080 C 
ATOM     24  C   LIG    1       -5.073  -1.427  -0.989  0.00  0.00    +0.234 C 
ATOM     25  O   LIG    1       -5.875  -0.833   0.056  0.00  0.00    -0.491 OA
ATOM     26  C   LIG    1       -5.115   0.221   0.491  0.00  0.00    +0.124 A 
ATOM     27  C   LIG    1       -5.585   1.213   1.327  0.00  0.00    +0.049 A 
ATOM     28  C   LIG    1       -4.699   2.223   1.697  0.00  0.00    +0.042 A 
ENDBRANCH  18  21
ENDBRANCH  16  18
ENDBRANCH   1  16
TORSDOF 4