REMARK  Name = LIG000337
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.611   0.581   0.286  0.00  0.00    -0.222 N 
ATOM      2  C   LIG    1        1.483   0.995   0.942  0.00  0.00    +0.255 C 
ATOM      3  O   LIG    1        1.386   1.656   1.958  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        0.345   0.446   0.209  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1        0.846  -0.287  -0.847  0.00  0.00    +0.050 A 
ATOM      6  C   LIG    1        0.018  -0.936  -1.737  0.00  0.00    +0.015 A 
ATOM      7  C   LIG    1       -1.362  -0.825  -1.521  0.00  0.00    +0.024 A 
ATOM      8  C   LIG    1       -1.893  -0.085  -0.433  0.00  0.00    +0.030 A 
ATOM      9  C   LIG    1       -1.012   0.569   0.442  0.00  0.00    +0.037 A 
ATOM     10  C   LIG    1        2.303  -0.202  -0.791  0.00  0.00    +0.254 C 
ATOM     11  O   LIG    1        3.051  -0.735  -1.587  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1        7.240  -0.578  -1.351  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1        6.293  -0.151  -0.696  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1        5.856   1.139  -0.856  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        6.301   1.639  -1.614  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        4.671   1.673  -0.418  0.00  0.00    +0.240 C 
ATOM     17  O   LIG    1        4.200   2.675  -0.956  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1        3.958   0.934   0.713  0.00  0.00    +0.171 C 
ATOM     19  C   LIG    1        4.771  -0.215   1.305  0.00  0.00    +0.041 C 
ATOM     20  C   LIG    1        5.526  -1.024   0.267  0.00  0.00    +0.098 C 
ENDBRANCH   1  18
BRANCH   8  21
ATOM     21  N   LIG    1       -3.286   0.018  -0.254  0.00  0.00    -0.328 N 
ATOM     22  C   LIG    1       -4.315  -0.873  -0.735  0.00  0.00    +0.118 C 
ATOM     23  C   LIG    1       -5.203  -0.223   0.272  0.00  0.00    +0.049 C 
ATOM     24  C   LIG    1       -6.208  -1.016   1.028  0.00  0.00    +0.172 C 
ATOM     25  O   LIG    1       -7.274  -0.141   0.552  0.00  0.00    -0.378 OA
ATOM     26  C   LIG    1       -6.307   0.674  -0.178  0.00  0.00    +0.172 C 
ATOM     27  C   LIG    1       -4.006   0.350   0.953  0.00  0.00    +0.118 C 
ENDBRANCH   8  21
TORSDOF 2