REMARK  Name = BDB014280
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.060  -1.294  -0.304  0.00  0.00    +0.026 A 
ATOM      2  N   LIG    1       -0.659  -0.159   0.197  0.00  0.00    -0.356 N 
ATOM      3  H   LIG    1       -0.179   0.652   0.569  0.00  0.00    +0.166 HD
ATOM      4  C   LIG    1       -2.028  -0.253   0.102  0.00  0.00    +0.079 A 
ATOM      5  C   LIG    1       -2.309  -1.485  -0.475  0.00  0.00    +0.090 A 
ATOM      6  N   LIG    1       -3.567  -1.919  -0.722  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1       -4.547  -1.062  -0.369  0.00  0.00    +0.112 A 
ATOM      8  C   LIG    1       -4.359   0.183   0.207  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1       -3.058   0.621   0.459  0.00  0.00    +0.086 A 
ATOM     10  C   LIG    1       -1.077  -2.133  -0.727  0.00  0.00    +0.051 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1        1.905  -2.112   0.987  0.00  0.00    +0.019 C 
ATOM     12  C   LIG    1        1.435  -1.483  -0.332  0.00  0.00    +0.062 C 
BRANCH  12  13
ATOM     13  C   LIG    1        2.169  -0.205  -0.731  0.00  0.00    -0.039 A 
ATOM     14  C   LIG    1        2.155   0.185  -2.085  0.00  0.00    +0.007 A 
ATOM     15  C   LIG    1        2.790   1.357  -2.500  0.00  0.00    +0.038 A 
ATOM     16  C   LIG    1        3.440   2.149  -1.564  0.00  0.00    +0.123 A 
ATOM     17  F   LIG    1        4.048   3.275  -1.959  0.00  0.00    -0.205 F 
ATOM     18  C   LIG    1        3.464   1.793  -0.222  0.00  0.00    +0.038 A 
ATOM     19  C   LIG    1        2.828   0.621   0.196  0.00  0.00    +0.007 A 
ENDBRANCH  12  13
ENDBRANCH   1  12
BRANCH   9  20
ATOM     20  C   LIG    1       -2.839   1.944   1.070  0.00  0.00    +0.339 C 
ATOM     21  O   LIG    1       -3.713   2.730   1.386  0.00  0.00    -0.245 OA
BRANCH  20  22
ATOM     22  O   LIG    1       -1.537   2.234   1.263  0.00  0.00    -0.477 OA
ATOM     23  H   LIG    1       -1.566   3.133   1.657  0.00  0.00    +0.295 HD
ENDBRANCH  20  22
ENDBRANCH   9  20
TORSDOF 4