REMARK  Name = LIG001031
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.816  -0.498   0.447  0.00  0.00    +0.139 C 
ATOM      2  C   LIG    1       -0.762   1.036   0.480  0.00  0.00    +0.236 C 
ATOM      3  O   LIG    1       -1.750   1.737   0.693  0.00  0.00    -0.274 OA
ATOM      4  N   LIG    1        0.474   1.601   0.278  0.00  0.00    -0.255 N 
ATOM      5  H   LIG    1        0.507   2.611   0.297  0.00  0.00    +0.158 HD
ATOM      6  C   LIG    1        1.621   0.974  -0.138  0.00  0.00    +0.219 C 
ATOM      7  O   LIG    1        2.634   1.617  -0.398  0.00  0.00    -0.275 OA
ATOM      8  C   LIG    1        1.582  -0.534  -0.205  0.00  0.00    +0.098 C 
ATOM      9  C   LIG    1        0.191  -1.034  -0.564  0.00  0.00    +0.037 C 
ENDROOT
BRANCH   1  10
ATOM     10  N   LIG    1       -2.171  -0.954   0.094  0.00  0.00    -0.320 NA
ATOM     11  H   LIG    1       -2.828  -0.497   0.735  0.00  0.00    +0.119 HD
ATOM     12  H   LIG    1       -2.425  -0.579  -0.822  0.00  0.00    +0.119 HD
ENDBRANCH   1  10
TORSDOF 1