REMARK  Name = LIG001982
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.650  -0.206   1.090  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -3.035   0.057   2.308  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -3.555   0.234   3.393  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.591   0.077   2.058  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -1.382  -0.120   0.698  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1       -0.096  -0.147   0.178  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1        0.986   0.031   1.051  0.00  0.00    +0.034 A 
ATOM      8  C   LIG    1        0.746   0.234   2.431  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1       -0.553   0.259   2.948  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -2.690  -0.266  -0.005  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -6.821   0.253  -2.860  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -6.393   0.101  -1.719  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -6.361   1.144  -0.835  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -6.592   2.030  -1.267  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -5.440   1.241   0.177  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -4.919   2.323   0.436  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -5.093  -0.071   0.904  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -5.736  -1.295   0.251  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -5.767  -1.194  -1.264  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  N   LIG    1        2.337   0.021   0.640  0.00  0.00    -0.280 N 
ATOM     21  H   LIG    1        3.013   0.184   1.372  0.00  0.00    +0.155 HD
ATOM     22  C   LIG    1        2.832  -0.133  -0.650  0.00  0.00    +0.268 C 
ATOM     23  O   LIG    1        2.136  -0.261  -1.653  0.00  0.00    -0.268 OA
BRANCH  22  24
ATOM     24  C   LIG    1        4.315  -0.122  -0.731  0.00  0.00    +0.150 A 
ATOM     25  N   LIG    1        4.940   0.034  -1.913  0.00  0.00    -0.160 NA
ATOM     26  N   LIG    1        6.260  -0.008  -1.638  0.00  0.00    -0.221 N 
ATOM     27  C   LIG    1        6.500  -0.191  -0.277  0.00  0.00    +0.156 A 
ATOM     28  N   LIG    1        7.764  -0.265   0.240  0.00  0.00    -0.236 NA
ATOM     29  C   LIG    1        8.732  -0.154  -0.622  0.00  0.00    +0.114 A 
ATOM     30  C   LIG    1        8.584   0.043  -2.091  0.00  0.00    +0.039 A 
ATOM     31  C   LIG    1        7.320   0.107  -2.531  0.00  0.00    +0.116 A 
ATOM     32  C   LIG    1        5.263  -0.272   0.316  0.00  0.00    +0.083 A 
ENDBRANCH  22  24
ENDBRANCH   7  20
TORSDOF 3