REMARK  Name = BDB048901
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.920   0.149  -0.257  0.00  0.00    +0.141 A 
ATOM      2  N   LIG    1        1.771  -0.081   0.804  0.00  0.00    -0.337 N 
ATOM      3  H   LIG    1        1.486  -0.312   1.743  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1        3.062   0.076   0.376  0.00  0.00    +0.086 A 
ATOM      5  C   LIG    1        2.932   0.410  -0.963  0.00  0.00    +0.178 A 
ATOM      6  N   LIG    1        3.988   0.658  -1.768  0.00  0.00    -0.234 NA
ATOM      7  C   LIG    1        5.192   0.552  -1.161  0.00  0.00    +0.125 A 
ATOM      8  C   LIG    1        5.410   0.216   0.175  0.00  0.00    +0.075 A 
ATOM      9  C   LIG    1        4.303  -0.030   0.999  0.00  0.00    +0.043 A 
ATOM     10  N   LIG    1        1.621   0.455  -1.337  0.00  0.00    -0.208 NA
ENDROOT
BRANCH   1  14
ATOM     11  C   LIG    1       -3.418  -0.029  -0.119  0.00  0.00    +0.029 A 
ATOM     12  C   LIG    1       -2.713   0.489  -1.216  0.00  0.00    +0.024 A 
ATOM     13  C   LIG    1       -1.310   0.534  -1.252  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1       -0.543   0.077  -0.178  0.00  0.00    +0.017 A 
ATOM     15  C   LIG    1       -1.223  -0.430   0.930  0.00  0.00    +0.013 A 
ATOM     16  C   LIG    1       -2.628  -0.474   0.955  0.00  0.00    +0.024 A 
BRANCH  11  18
ATOM     17  C   LIG    1       -5.578   0.267  -1.276  0.00  0.00    +0.129 C 
ATOM     18  N   LIG    1       -4.817  -0.060  -0.071  0.00  0.00    -0.336 N 
ATOM     19  C   LIG    1       -5.464  -1.001   0.843  0.00  0.00    +0.129 C 
ENDBRANCH  11  18
ENDBRANCH   1  14
BRANCH   8  20
ATOM     20  C   LIG    1        6.814   0.161   0.699  0.00  0.00    +0.419 C 
ATOM     21  F   LIG    1        7.318   1.397   0.961  0.00  0.00    -0.166 F 
ATOM     22  F   LIG    1        7.683  -0.423  -0.171  0.00  0.00    -0.166 F 
ATOM     23  F   LIG    1        6.925  -0.542   1.861  0.00  0.00    -0.166 F 
ENDBRANCH   8  20
TORSDOF 3