REMARK  Name = BDB065351
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.909   1.104   0.425  0.00  0.00    -0.182 NA
ATOM      2  H   LIG    1       -0.994   2.117   0.350  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1   3
ATOM      3  S   LIG    1        0.089   0.573   1.656  0.00  0.00    +0.059 S 
ATOM      4  O   LIG    1       -0.316  -0.774   1.990  0.00  0.00    -0.153 OA
ATOM      5  O   LIG    1        0.124   1.629   2.642  0.00  0.00    -0.153 OA
BRANCH   3   6
ATOM      6  C   LIG    1        1.675   0.507   0.866  0.00  0.00    +0.109 A 
ATOM      7  C   LIG    1        2.181  -0.722   0.434  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1        3.421  -0.714  -0.168  0.00  0.00    +0.126 A 
ATOM      9  O   LIG    1        4.043  -1.830  -0.662  0.00  0.00    -0.491 OA
ATOM     10  C   LIG    1        5.395  -1.381  -0.920  0.00  0.00    +0.234 C 
ATOM     11  C   LIG    1        5.397   0.141  -1.078  0.00  0.00    +0.080 C 
ATOM     12  C   LIG    1        4.149   0.454  -0.345  0.00  0.00    -0.002 A 
ATOM     13  C   LIG    1        3.661   1.675   0.085  0.00  0.00    +0.009 A 
ATOM     14  C   LIG    1        2.410   1.700   0.709  0.00  0.00    +0.029 A 
ENDBRANCH   3   6
ENDBRANCH   1   3
BRANCH   1  15
ATOM     15  C   LIG    1       -1.040   0.299  -0.789  0.00  0.00    +0.185 C 
BRANCH  15  17
ATOM     16  O   LIG    1       -2.564   0.749  -2.577  0.00  0.00    -0.291 OA
ATOM     17  C   LIG    1       -2.421   0.455  -1.392  0.00  0.00    +0.181 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -3.613   0.212  -0.537  0.00  0.00    +0.054 A 
ATOM     19  C   LIG    1       -4.780   0.943  -0.768  0.00  0.00    +0.134 A 
ATOM     20  F   LIG    1       -4.830   1.890  -1.716  0.00  0.00    -0.205 F 
ATOM     21  C   LIG    1       -5.918   0.734   0.008  0.00  0.00    +0.039 A 
ATOM     22  C   LIG    1       -5.898  -0.214   1.029  0.00  0.00    +0.003 A 
ATOM     23  C   LIG    1       -4.737  -0.949   1.271  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1       -3.596  -0.741   0.490  0.00  0.00    +0.014 A 
ENDBRANCH  17  18
ENDBRANCH  15  17
ENDBRANCH   1  15
TORSDOF 5