REMARK  Name = LIG000909
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.603  -0.720  -0.247  0.00  0.00    -0.222 N 
ATOM      2  C   LIG    1       -1.678   0.264  -0.466  0.00  0.00    +0.255 C 
ATOM      3  O   LIG    1       -1.849   1.435  -0.744  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -0.364  -0.345  -0.269  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1       -0.566  -1.660   0.105  0.00  0.00    +0.052 A 
ATOM      6  C   LIG    1        0.483  -2.510   0.373  0.00  0.00    +0.054 A 
ATOM      7  C   LIG    1        1.768  -1.979   0.250  0.00  0.00    +0.145 A 
ATOM      8  C   LIG    1        2.005  -0.626  -0.123  0.00  0.00    +0.066 A 
ATOM      9  F   LIG    1        2.803  -2.796   0.499  0.00  0.00    -0.204 F 
ATOM     10  C   LIG    1        0.901   0.200  -0.392  0.00  0.00    +0.039 A 
ATOM     11  C   LIG    1       -2.007  -1.889   0.143  0.00  0.00    +0.255 C 
ATOM     12  O   LIG    1       -2.524  -2.941   0.466  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  19
ATOM     13  O   LIG    1       -7.518   1.675   0.249  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -6.486   1.028   0.102  0.00  0.00    +0.219 C 
ATOM     15  N   LIG    1       -5.619   0.830   1.149  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -5.857   1.301   2.012  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -4.389   0.212   1.121  0.00  0.00    +0.240 C 
ATOM     18  O   LIG    1       -3.667   0.214   2.116  0.00  0.00    -0.273 OA
ATOM     19  C   LIG    1       -4.042  -0.513  -0.184  0.00  0.00    +0.171 C 
ATOM     20  C   LIG    1       -4.622   0.243  -1.375  0.00  0.00    +0.041 C 
ATOM     21  C   LIG    1       -6.130   0.361  -1.207  0.00  0.00    +0.098 C 
ENDBRANCH   1  19
BRANCH   8  22
ATOM     22  N   LIG    1        3.315  -0.115  -0.253  0.00  0.00    -0.326 N 
ATOM     23  C   LIG    1        3.745   1.261  -0.159  0.00  0.00    +0.118 C 
ATOM     24  C   LIG    1        5.115   0.710   0.050  0.00  0.00    +0.049 C 
ATOM     25  C   LIG    1        6.059   1.356   0.998  0.00  0.00    +0.172 C 
ATOM     26  O   LIG    1        7.029   1.541  -0.075  0.00  0.00    -0.378 OA
ATOM     27  C   LIG    1        6.147   0.858  -1.017  0.00  0.00    +0.172 C 
ATOM     28  C   LIG    1        4.528  -0.629   0.341  0.00  0.00    +0.118 C 
ENDBRANCH   8  22
TORSDOF 2