REMARK  Name = LIG000525
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.014   0.266   0.424  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1        0.843   0.052   1.494  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1        0.562  -0.074   2.670  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        2.201  -0.002   0.946  0.00  0.00    +0.047 A 
ATOM      5  C   LIG    1        2.107   0.111  -0.439  0.00  0.00    +0.017 A 
ATOM      6  C   LIG    1        3.250   0.085  -1.204  0.00  0.00    +0.131 A 
ATOM      7  C   LIG    1        4.488  -0.052  -0.580  0.00  0.00    +0.077 A 
ATOM      8  C   LIG    1        4.551  -0.165   0.815  0.00  0.00    +0.127 A 
ATOM      9  F   LIG    1        5.748  -0.297   1.402  0.00  0.00    -0.205 F 
ATOM     10  F   LIG    1        3.177   0.190  -2.536  0.00  0.00    -0.205 F 
ATOM     11  C   LIG    1        3.406  -0.143   1.605  0.00  0.00    +0.052 A 
ATOM     12  C   LIG    1        0.684   0.226  -0.857  0.00  0.00    +0.147 C 
ENDROOT
BRANCH   1  19
ATOM     13  O   LIG    1       -5.262  -0.751  -0.778  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -4.165  -0.481  -0.300  0.00  0.00    +0.219 C 
ATOM     15  N   LIG    1       -3.276  -1.472   0.035  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -3.569  -2.405  -0.224  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -1.917  -1.315   0.187  0.00  0.00    +0.240 C 
ATOM     18  O   LIG    1       -1.159  -2.268   0.022  0.00  0.00    -0.273 OA
ATOM     19  C   LIG    1       -1.458   0.107   0.555  0.00  0.00    +0.163 C 
ATOM     20  C   LIG    1       -2.237   1.113  -0.286  0.00  0.00    +0.041 C 
ATOM     21  C   LIG    1       -3.727   0.939  -0.030  0.00  0.00    +0.098 C 
ENDBRANCH   1  19
TORSDOF 1