REMARK  Name = LIG001224
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.096   0.053  -0.301  0.00  0.00    -0.300 N 
ATOM      2  H   LIG    1        0.420  -0.080  -1.166  0.00  0.00    +0.150 HD
ATOM      3  C   LIG    1        0.599   0.426   0.829  0.00  0.00    +0.245 C 
ATOM      4  O   LIG    1        0.059   0.944   1.800  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  11
ATOM      5  O   LIG    1       -5.323  -0.589  -1.700  0.00  0.00    -0.275 OA
ATOM      6  C   LIG    1       -4.213  -0.245  -1.305  0.00  0.00    +0.219 C 
ATOM      7  N   LIG    1       -3.236   0.134  -2.191  0.00  0.00    -0.255 N 
ATOM      8  H   LIG    1       -3.479   0.017  -3.166  0.00  0.00    +0.158 HD
ATOM      9  C   LIG    1       -1.893   0.217  -1.923  0.00  0.00    +0.240 C 
ATOM     10  O   LIG    1       -1.059   0.184  -2.828  0.00  0.00    -0.273 OA
ATOM     11  C   LIG    1       -1.510   0.371  -0.448  0.00  0.00    +0.160 C 
ATOM     12  C   LIG    1       -2.398  -0.542   0.392  0.00  0.00    +0.041 C 
ATOM     13  C   LIG    1       -3.857  -0.181   0.162  0.00  0.00    +0.098 C 
ENDBRANCH   1  11
BRANCH   3  14
ATOM     14  C   LIG    1        2.073   0.207   0.808  0.00  0.00    +0.037 A 
ATOM     15  C   LIG    1        2.673  -0.760  -0.009  0.00  0.00    +0.013 A 
ATOM     16  C   LIG    1        4.060  -0.929   0.010  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1        4.850  -0.140   0.846  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        4.257   0.814   1.672  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1        2.872   0.985   1.657  0.00  0.00    +0.013 A 
ENDBRANCH   3  14
TORSDOF 2