REMARK  Name = LIG001962
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.901  -0.578   0.555  0.00  0.00    -0.222 N 
ATOM      2  C   LIG    1       -2.821  -1.052   1.252  0.00  0.00    +0.255 C 
ATOM      3  O   LIG    1       -2.755  -1.423   2.408  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.690  -1.052   0.328  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1       -2.139  -0.549  -0.878  0.00  0.00    +0.049 A 
ATOM      6  C   LIG    1       -1.302  -0.402  -1.965  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        0.032  -0.792  -1.801  0.00  0.00    +0.006 A 
ATOM      8  C   LIG    1        0.502  -1.320  -0.570  0.00  0.00    -0.030 A 
ATOM      9  C   LIG    1       -0.378  -1.444   0.518  0.00  0.00    +0.019 A 
ATOM     10  C   LIG    1       -3.554  -0.224  -0.719  0.00  0.00    +0.254 C 
ATOM     11  O   LIG    1       -4.236   0.292  -1.582  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1       -8.326   2.059  -0.185  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -7.436   1.312   0.210  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1       -6.594   1.703   1.216  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -6.683   2.687   1.437  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -5.340   1.186   1.403  0.00  0.00    +0.240 C 
ATOM     17  O   LIG    1       -4.410   1.909   1.755  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1       -5.193  -0.322   1.176  0.00  0.00    +0.171 C 
ATOM     19  C   LIG    1       -6.390  -0.962   0.471  0.00  0.00    +0.041 C 
ATOM     20  C   LIG    1       -7.150  -0.016  -0.444  0.00  0.00    +0.098 C 
ENDBRANCH   1  18
BRANCH   8  21
ATOM     21  C   LIG    1        1.953  -1.701  -0.424  0.00  0.00    +0.141 C 
BRANCH  21  22
ATOM     22  N   LIG    1        2.763  -0.528  -0.188  0.00  0.00    -0.295 N 
ATOM     23  H   LIG    1        2.404   0.124   0.492  0.00  0.00    +0.151 HD
ATOM     24  C   LIG    1        4.139  -0.663  -0.181  0.00  0.00    +0.304 C 
ATOM     25  N   LIG    1        4.739   0.536   0.128  0.00  0.00    -0.269 N 
ATOM     26  H   LIG    1        4.137   1.344   0.082  0.00  0.00    +0.156 HD
ATOM     27  O   LIG    1        4.691  -1.724  -0.437  0.00  0.00    -0.252 OA
BRANCH  25  28
ATOM     28  C   LIG    1        6.113   0.789   0.311  0.00  0.00    +0.035 A 
ATOM     29  C   LIG    1        7.088  -0.209   0.354  0.00  0.00    +0.023 A 
ATOM     30  C   LIG    1        8.433   0.122   0.550  0.00  0.00    +0.002 A 
ATOM     31  C   LIG    1        8.813   1.453   0.707  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1        7.848   2.455   0.670  0.00  0.00    +0.002 A 
ATOM     33  C   LIG    1        6.504   2.124   0.475  0.00  0.00    +0.023 A 
ENDBRANCH  25  28
ENDBRANCH  21  22
ENDBRANCH   8  21
TORSDOF 4