REMARK  Name = LIG001233
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -5.141   1.076  -0.421  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1       -3.990   0.688  -0.252  0.00  0.00    +0.219 C 
ATOM      3  N   LIG    1       -3.196   1.223   0.731  0.00  0.00    -0.255 N 
ATOM      4  H   LIG    1       -3.629   1.937   1.302  0.00  0.00    +0.158 HD
ATOM      5  C   LIG    1       -1.994   0.734   1.200  0.00  0.00    +0.246 C 
ATOM      6  O   LIG    1       -1.558   1.140   2.276  0.00  0.00    -0.273 OA
ATOM      7  C   LIG    1       -1.354  -0.373   0.386  0.00  0.00    +0.214 C 
ATOM      8  C   LIG    1       -1.883  -0.387  -1.050  0.00  0.00    +0.047 C 
ATOM      9  C   LIG    1       -3.401  -0.458  -1.038  0.00  0.00    +0.099 C 
ENDROOT
BRANCH   7  10
ATOM     10  N   LIG    1        0.096  -0.260   0.418  0.00  0.00    -0.170 N 
ATOM     11  N   LIG    1        0.718   0.797  -0.138  0.00  0.00    -0.151 NA
ATOM     12  C   LIG    1        2.014   0.485   0.025  0.00  0.00    +0.113 A 
ATOM     13  C   LIG    1        2.095  -0.847   0.636  0.00  0.00    +0.113 A 
ATOM     14  C   LIG    1        3.323  -1.467   0.925  0.00  0.00    +0.032 A 
ATOM     15  C   LIG    1        4.456  -0.703   0.585  0.00  0.00    +0.002 A 
ATOM     16  C   LIG    1        4.378   0.588  -0.007  0.00  0.00    +0.002 A 
ATOM     17  C   LIG    1        3.160   1.227  -0.310  0.00  0.00    +0.032 A 
ATOM     18  N   LIG    1        0.845  -1.301   0.825  0.00  0.00    -0.151 NA
ENDBRANCH   7  10
TORSDOF 1