REMARK  Name = LIG001166
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.521   0.546   0.145  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -2.938   0.877   1.356  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -3.286   1.721   2.156  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.750   0.029   1.500  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -1.614  -0.727   0.342  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1       -0.563  -1.620   0.211  0.00  0.00    +0.028 A 
ATOM      7  C   LIG    1        0.381  -1.733   1.251  0.00  0.00    +0.028 A 
ATOM      8  C   LIG    1        0.189  -0.976   2.429  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1       -0.873  -0.073   2.558  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -2.707  -0.394  -0.614  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -6.258   4.632   1.332  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -5.797   3.609   0.830  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -4.901   3.687  -0.203  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -4.611   4.622  -0.454  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -4.248   2.667  -0.846  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -3.351   2.907  -1.655  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -4.646   1.239  -0.472  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -5.969   1.154   0.284  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -6.166   2.236   1.330  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  N   LIG    1        1.412  -2.675   1.119  0.00  0.00    -0.340 N 
ATOM     21  H   LIG    1        1.476  -3.024   0.165  0.00  0.00    +0.146 HD
BRANCH  20  22
ATOM     22  C   LIG    1        2.745  -2.353   1.628  0.00  0.00    +0.137 C 
BRANCH  22  23
ATOM     23  C   LIG    1        3.539  -1.599   0.585  0.00  0.00    -0.030 A 
ATOM     24  C   LIG    1        4.342  -2.290  -0.337  0.00  0.00    +0.013 A 
ATOM     25  C   LIG    1        5.066  -1.607  -1.328  0.00  0.00    -0.018 A 
ATOM     26  C   LIG    1        4.978  -0.197  -1.402  0.00  0.00    -0.017 A 
ATOM     27  C   LIG    1        5.700   0.488  -2.392  0.00  0.00    +0.023 A 
ATOM     28  C   LIG    1        6.497  -0.215  -3.295  0.00  0.00    +0.018 A 
ATOM     29  C   LIG    1        6.588  -1.602  -3.228  0.00  0.00    +0.016 A 
ATOM     30 BR   LIG    1        7.461   0.724  -4.623  0.00  0.00    -0.050 Br
ATOM     31  C   LIG    1        4.168   0.488  -0.484  0.00  0.00    +0.009 A 
ATOM     32  C   LIG    1        5.875  -2.295  -2.248  0.00  0.00    +0.009 A 
ATOM     33  C   LIG    1        3.455  -0.205   0.496  0.00  0.00    +0.006 A 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   7  20
TORSDOF 4