REMARK  Name = BDB057128
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.098  -2.243   1.003  0.00  0.00    -0.292 OA
ATOM      2  C   LIG    1       -1.068  -1.206   0.341  0.00  0.00    +0.165 C 
ATOM      3  C   LIG    1        0.210  -0.453   0.211  0.00  0.00    +0.032 A 
ATOM      4  C   LIG    1        0.296   0.755  -0.497  0.00  0.00    +0.018 A 
ATOM      5  C   LIG    1        1.543   1.389  -0.611  0.00  0.00    +0.017 A 
ATOM      6  C   LIG    1        2.682   0.840  -0.017  0.00  0.00    +0.021 A 
ATOM      7  C   LIG    1        2.582  -0.352   0.693  0.00  0.00    +0.042 A 
ATOM      8 CL   LIG    1        3.984  -1.027   1.426  0.00  0.00    -0.084 Cl
ATOM      9  S   LIG    1       -1.091   1.554  -1.281  0.00  0.00    -0.124 S 
ATOM     10  C   LIG    1       -2.434   0.779  -0.346  0.00  0.00    +0.082 C 
ATOM     11  C   LIG    1        1.357  -1.001   0.809  0.00  0.00    +0.032 A 
ATOM     12  C   LIG    1       -2.295  -0.725  -0.393  0.00  0.00    +0.090 C 
ENDROOT
TORSDOF 0