REMARK  Name = BDB060891
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.905   0.354  -0.315  0.00  0.00    +0.044 C 
ATOM      2  C   LIG    1       -1.440   0.160  -0.043  0.00  0.00    -0.047 A 
ATOM      3  C   LIG    1       -0.549  -0.050  -1.109  0.00  0.00    +0.051 A 
ATOM      4  C   LIG    1        0.788  -0.191  -0.806  0.00  0.00    +0.154 A 
ATOM      5  C   LIG    1        1.242  -0.117   0.495  0.00  0.00    +0.085 A 
ATOM      6  N   LIG    1        2.597  -0.294   0.439  0.00  0.00    -0.317 N 
ATOM      7  H   LIG    1        3.249  -0.298   1.207  0.00  0.00    +0.169 HD
ATOM      8  C   LIG    1        2.917  -0.466  -0.883  0.00  0.00    +0.247 A 
ATOM      9  S   LIG    1        4.423  -0.718  -1.511  0.00  0.00    +0.009 S 
ATOM     10  C   LIG    1        0.411   0.099   1.567  0.00  0.00    +0.030 A 
ATOM     11  O   LIG    1        1.808  -0.409  -1.721  0.00  0.00    -0.431 OA
ATOM     12  C   LIG    1       -0.951   0.245   1.284  0.00  0.00    +0.005 A 
ENDROOT
TORSDOF 0