REMARK  Name = LIG000683
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -4.572   0.253   0.146  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1       -3.348   0.168   0.108  0.00  0.00    +0.222 C 
ATOM      3  N   LIG    1       -2.582   0.324   1.231  0.00  0.00    -0.240 N 
ATOM      4  H   LIG    1       -3.070   0.554   2.084  0.00  0.00    +0.159 HD
ATOM      5  C   LIG    1       -1.209   0.372   1.305  0.00  0.00    +0.313 C 
ATOM      6  O   LIG    1       -0.678   0.675   2.369  0.00  0.00    -0.252 OA
ATOM      7  N   LIG    1       -0.543   0.022   0.129  0.00  0.00    -0.253 N 
ATOM      8  C   LIG    1       -1.283  -0.728  -0.873  0.00  0.00    +0.124 C 
ATOM      9  C   LIG    1       -2.596  -0.036  -1.175  0.00  0.00    +0.115 C 
ENDROOT
BRANCH   7  10
ATOM     10  C   LIG    1        0.887   0.034   0.087  0.00  0.00    +0.056 A 
ATOM     11  C   LIG    1        1.640   1.181   0.413  0.00  0.00    +0.062 A 
ATOM     12 CL   LIG    1        0.912   2.730   0.688  0.00  0.00    -0.082 Cl
ATOM     13  C   LIG    1        3.039   1.141   0.389  0.00  0.00    +0.022 A 
ATOM     14  C   LIG    1        3.705  -0.029   0.027  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1        2.974  -1.158  -0.329  0.00  0.00    +0.002 A 
ATOM     16  C   LIG    1        1.576  -1.126  -0.306  0.00  0.00    +0.025 A 
ENDBRANCH   7  10
TORSDOF 1