REMARK  Name = LIG001620
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.148  -0.889  -0.741  0.00  0.00    -0.029 A 
ATOM      2  C   LIG    1       -0.872  -0.268  -0.010  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1       -2.210  -0.602  -0.258  0.00  0.00    +0.068 A 
ATOM      4  C   LIG    1       -2.566  -1.530  -1.221  0.00  0.00    +0.100 A 
ATOM      5  N   LIG    1       -3.894  -1.883  -1.481  0.00  0.00    -0.131 NA
ATOM      6  N   LIG    1       -4.817  -1.363  -0.821  0.00  0.00    -0.061 NA
ATOM      7  N   LIG    1       -4.577  -0.396   0.117  0.00  0.00    -0.198 N 
ATOM      8  C   LIG    1       -1.545  -2.139  -1.960  0.00  0.00    +0.031 A 
ATOM      9  C   LIG    1       -3.307   0.012   0.484  0.00  0.00    +0.278 A 
ATOM     10  O   LIG    1       -3.068   0.843   1.356  0.00  0.00    -0.265 OA
ATOM     11  C   LIG    1       -0.202  -1.821  -1.727  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   7  12
ATOM     12  C   LIG    1       -5.723   0.060   0.900  0.00  0.00    +0.199 C 
ATOM     13  C   LIG    1       -6.030  -0.957   2.005  0.00  0.00    +0.244 C 
ATOM     14  O   LIG    1       -5.224  -1.777   2.441  0.00  0.00    -0.273 OA
ATOM     15  N   LIG    1       -7.292  -0.875   2.554  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -7.493  -1.540   3.289  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -8.368  -0.166   2.082  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1       -9.480  -0.291   2.587  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -8.098   0.799   0.953  0.00  0.00    +0.099 C 
ATOM     20  C   LIG    1       -6.976   0.298   0.057  0.00  0.00    +0.046 C 
ENDBRANCH   7  12
BRANCH   1  21
ATOM     21  C   LIG    1        1.590  -0.532  -0.503  0.00  0.00    +0.141 C 
BRANCH  21  25
ATOM     22  N   LIG    1        4.248   0.534  -0.743  0.00  0.00    -0.269 N 
ATOM     23  H   LIG    1        3.923  -0.031   0.022  0.00  0.00    +0.156 HD
ATOM     24  C   LIG    1        3.307   0.944  -1.647  0.00  0.00    +0.304 C 
ATOM     25  N   LIG    1        2.056   0.430  -1.473  0.00  0.00    -0.295 N 
ATOM     26  H   LIG    1        1.402   0.771  -2.167  0.00  0.00    +0.151 HD
ATOM     27  O   LIG    1        3.476   1.713  -2.587  0.00  0.00    -0.252 OA
BRANCH  22  31
ATOM     28  C   LIG    1        8.542   0.082   1.617  0.00  0.00    +0.044 C 
ATOM     29  C   LIG    1        7.742   0.653   0.484  0.00  0.00    -0.049 A 
ATOM     30  C   LIG    1        6.373   0.368   0.362  0.00  0.00    +0.026 A 
ATOM     31  C   LIG    1        5.618   0.871  -0.708  0.00  0.00    +0.035 A 
ATOM     32  C   LIG    1        6.255   1.656  -1.670  0.00  0.00    +0.023 A 
ATOM     33  C   LIG    1        7.621   1.933  -1.565  0.00  0.00    +0.002 A 
ATOM     34  C   LIG    1        8.362   1.431  -0.497  0.00  0.00    +0.003 A 
ENDBRANCH  22  31
ENDBRANCH  21  25
ENDBRANCH   1  21
TORSDOF 4