REMARK  Name = LIG000276
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.458   0.888  -0.001  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1        1.244   2.250   0.144  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1        2.074   3.124   0.305  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -0.204   2.463   0.067  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -0.903   3.654   0.092  0.00  0.00    +0.013 A 
ATOM      6  C   LIG    1       -2.291   3.580  -0.005  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -2.935   2.332  -0.120  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1       -2.211   1.122  -0.136  0.00  0.00    -0.012 A 
ATOM      9  C   LIG    1       -0.826   1.218  -0.044  0.00  0.00    -0.010 A 
ATOM     10  C   LIG    1        0.208   0.139  -0.039  0.00  0.00    +0.145 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1        5.293  -2.777   1.369  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        4.610  -1.814   1.033  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1        3.939  -1.063   1.964  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1        3.987  -1.423   2.909  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1        2.852  -0.257   1.712  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1        2.039  -0.016   2.602  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1        2.753   0.276   0.272  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1        3.080  -0.855  -0.698  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1        4.478  -1.380  -0.408  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   8  20
ATOM     20  C   LIG    1       -2.899  -0.167  -0.247  0.00  0.00    -0.017 A 
ATOM     21  C   LIG    1       -3.550  -0.531  -1.438  0.00  0.00    +0.011 A 
ATOM     22  C   LIG    1       -4.200  -1.762  -1.547  0.00  0.00    +0.039 A 
ATOM     23  C   LIG    1       -4.206  -2.632  -0.464  0.00  0.00    +0.123 A 
ATOM     24  F   LIG    1       -4.829  -3.813  -0.569  0.00  0.00    -0.205 F 
ATOM     25  C   LIG    1       -3.575  -2.295   0.726  0.00  0.00    +0.039 A 
ATOM     26  C   LIG    1       -2.923  -1.064   0.835  0.00  0.00    +0.011 A 
ENDBRANCH   8  20
TORSDOF 2