REMARK  Name = BDB018896
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.427   0.290   0.606  0.00  0.00    +0.167 A 
ATOM      2  S   LIG    1        0.479   0.990   2.168  0.00  0.00    -0.060 S 
ATOM      3  C   LIG    1        2.137   0.589   2.304  0.00  0.00    +0.076 A 
ATOM      4  C   LIG    1        2.553  -0.076   1.169  0.00  0.00    +0.080 A 
ATOM      5  N   LIG    1        1.559  -0.264   0.220  0.00  0.00    -0.224 NA
ENDROOT
BRANCH   4   6
ATOM      6  C   LIG    1        3.904  -0.585   0.948  0.00  0.00    +0.002 A 
ATOM      7  C   LIG    1        5.014  -0.080   1.642  0.00  0.00    +0.033 A 
ATOM      8  C   LIG    1        6.292  -0.594   1.397  0.00  0.00    +0.077 A 
ATOM      9 CL   LIG    1        7.637   0.044   2.263  0.00  0.00    -0.081 Cl
ATOM     10  C   LIG    1        6.469  -1.609   0.461  0.00  0.00    +0.142 A 
ATOM     11  F   LIG    1        7.688  -2.112   0.215  0.00  0.00    -0.204 F 
ATOM     12  C   LIG    1        5.383  -2.117  -0.241  0.00  0.00    +0.040 A 
ATOM     13  C   LIG    1        4.106  -1.605   0.001  0.00  0.00    +0.013 A 
ENDBRANCH   4   6
BRANCH   1  15
ATOM     14  C   LIG    1       -0.744  -0.682  -1.308  0.00  0.00    +0.140 C 
ATOM     15  N   LIG    1       -0.754   0.210  -0.146  0.00  0.00    -0.252 N 
ATOM     16  C   LIG    1       -1.802   1.124   0.065  0.00  0.00    +0.242 C 
ATOM     17  O   LIG    1       -1.728   2.121   0.788  0.00  0.00    -0.273 OA
BRANCH  16  18
ATOM     18  C   LIG    1       -3.121   0.849  -0.686  0.00  0.00    +0.170 C 
ATOM     19  N   LIG    1       -3.976  -0.230  -0.063  0.00  0.00    -0.258 N 
ATOM     20  C   LIG    1       -5.381   0.265   0.005  0.00  0.00    +0.117 C 
ATOM     21  C   LIG    1       -5.417   1.464  -0.924  0.00  0.00    +0.022 C 
ATOM     22  C   LIG    1       -4.047   2.075  -0.713  0.00  0.00    +0.034 C 
BRANCH  19  23
ATOM     23  C   LIG    1       -3.524  -1.219   0.720  0.00  0.00    +0.170 C 
ATOM     24  N   LIG    1       -3.119  -2.080   1.378  0.00  0.00    -0.174 NA
ENDBRANCH  19  23
ENDBRANCH  16  18
ENDBRANCH   1  15
TORSDOF 4