REMARK  Name = BDB051491
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.629  -0.596   0.219  0.00  0.00    -0.278 N 
ATOM      2  C   LIG    1        0.296   0.392   0.495  0.00  0.00    +0.262 A 
ATOM      3  O   LIG    1        0.073   1.482   1.000  0.00  0.00    -0.267 OA
ATOM      4  C   LIG    1        1.655  -0.043   0.078  0.00  0.00    +0.041 A 
ATOM      5  C   LIG    1        2.815   0.851   0.321  0.00  0.00    +0.051 C 
ATOM      6  C   LIG    1        1.596  -1.252  -0.493  0.00  0.00    +0.103 A 
ATOM      7 CL   LIG    1        2.943  -2.104  -1.118  0.00  0.00    -0.074 Cl
ATOM      8  S   LIG    1        0.015  -1.948  -0.577  0.00  0.00    +0.004 S 
ENDROOT
BRANCH   1  10
ATOM      9  C   LIG    1       -2.705   0.264  -0.797  0.00  0.00    +0.028 C 
ATOM     10  C   LIG    1       -2.057  -0.426   0.393  0.00  0.00    +0.130 C 
ENDBRANCH   1  10
TORSDOF 1