REMARK  Name = BDB033473
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.167   0.738  -0.362  0.00  0.00    +0.077 A 
ATOM      2  C   LIG    1       -2.037   0.479  -1.189  0.00  0.00    +0.022 A 
ATOM      3  C   LIG    1       -1.258  -0.487  -0.537  0.00  0.00    +0.071 A 
ATOM      4  C   LIG    1       -0.058  -0.977  -1.079  0.00  0.00    +0.075 A 
ATOM      5  C   LIG    1        0.334  -0.493  -2.329  0.00  0.00    +0.065 A 
ATOM      6  C   LIG    1       -0.419   0.473  -2.980  0.00  0.00    +0.126 A 
ATOM      7  F   LIG    1       -0.009   0.928  -4.171  0.00  0.00    -0.205 F 
ATOM      8  N   LIG    1       -1.905  -0.782   0.647  0.00  0.00    -0.358 N 
ATOM      9  H   LIG    1       -1.524  -1.394   1.363  0.00  0.00    +0.165 HD
ATOM     10  C   LIG    1       -1.600   0.972  -2.435  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1       -3.057  -0.051   0.761  0.00  0.00    +0.102 A 
ENDROOT
BRANCH   1  13
ATOM     12  N   LIG    1       -5.100   2.398  -0.834  0.00  0.00    -0.191 NA
ATOM     13  C   LIG    1       -4.235   1.654  -0.620  0.00  0.00    +0.101 C 
ENDBRANCH   1  13
BRANCH   4  14
ATOM     14  N   LIG    1        0.711  -2.045  -0.523  0.00  0.00    -0.212 N 
ATOM     15  H   LIG    1        0.260  -2.957  -0.587  0.00  0.00    +0.174 HD
BRANCH  14  16
ATOM     16  S   LIG    1        1.396  -1.847   1.016  0.00  0.00    +0.096 S 
ATOM     17  O   LIG    1        0.306  -1.634   1.952  0.00  0.00    -0.148 OA
ATOM     18  O   LIG    1        2.300  -2.964   1.197  0.00  0.00    -0.148 OA
BRANCH  16  19
ATOM     19  C   LIG    1        2.400  -0.380   1.055  0.00  0.00    +0.236 A 
ATOM     20  S   LIG    1        3.140   0.022   2.545  0.00  0.00    -0.055 S 
ATOM     21  C   LIG    1        3.833   1.405   1.802  0.00  0.00    +0.068 A 
ATOM     22  C   LIG    1        3.453   1.462   0.477  0.00  0.00    +0.120 A 
ATOM     23  N   LIG    1        2.630   0.440   0.045  0.00  0.00    -0.229 NA
ENDBRANCH  16  19
ENDBRANCH  14  16
ENDBRANCH   4  14
TORSDOF 4