REMARK  Name = LIG001198
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.587  -0.507   0.069  0.00  0.00    +0.219 A 
ATOM      2  N   LIG    1       -2.314   0.418   0.713  0.00  0.00    -0.195 NA
ATOM      3  C   LIG    1       -1.561   1.248   1.445  0.00  0.00    +0.167 A 
ATOM      4  C   LIG    1       -0.185   1.230   1.568  0.00  0.00    +0.148 A 
ATOM      5  N   LIG    1        0.251   2.250   2.389  0.00  0.00    -0.231 NA
ATOM      6  C   LIG    1       -0.850   2.862   2.773  0.00  0.00    +0.201 A 
ATOM      7  C   LIG    1        0.499   0.232   0.854  0.00  0.00    +0.152 A 
ATOM      8  N   LIG    1       -1.973   2.292   2.229  0.00  0.00    -0.312 N 
ATOM      9  N   LIG    1       -0.244  -0.621   0.097  0.00  0.00    -0.197 NA
ENDROOT
BRANCH   8  10
ATOM     10  C   LIG    1       -3.340   2.732   2.464  0.00  0.00    +0.084 C 
ATOM     11  C   LIG    1       -4.026   3.201   1.180  0.00  0.00    +0.030 C 
ATOM     12  C   LIG    1       -4.169   1.671   3.187  0.00  0.00    +0.030 C 
ENDBRANCH   8  10
BRANCH   1  13
ATOM     13  N   LIG    1       -2.218  -1.453  -0.739  0.00  0.00    -0.308 N 
ATOM     14  H   LIG    1       -1.450  -1.812  -1.303  0.00  0.00    +0.149 HD
BRANCH  13  15
ATOM     15  CA  LIG    1       -3.374  -0.951  -1.499  0.00  0.00    +0.098 C 
BRANCH  15  17
ATOM     16  C   LIG    1       -5.906  -0.610  -1.335  0.00  0.00    +0.006 C 
ATOM     17  C   LIG    1       -4.661  -1.196  -0.683  0.00  0.00    +0.021 C 
ENDBRANCH  15  17
BRANCH  15  18
ATOM     18  C   LIG    1       -3.399  -1.699  -2.854  0.00  0.00    +0.178 C 
BRANCH  18  19
ATOM     19  O   LIG    1       -3.515  -3.110  -2.670  0.00  0.00    -0.393 OA
ATOM     20  H   LIG    1       -3.083  -3.315  -1.817  0.00  0.00    +0.209 HD
ENDBRANCH  18  19
ENDBRANCH  15  18
ENDBRANCH  13  15
ENDBRANCH   1  13
BRANCH   7  21
ATOM     21  N   LIG    1        1.893   0.114   0.920  0.00  0.00    -0.327 N 
ATOM     22  H   LIG    1        2.288   0.974   1.297  0.00  0.00    +0.148 HD
BRANCH  21  23
ATOM     23  C   LIG    1        2.528  -0.414  -0.274  0.00  0.00    +0.103 C 
BRANCH  23  24
ATOM     24  C   LIG    1        4.043  -0.446  -0.068  0.00  0.00    +0.023 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.750  -1.035  -1.289  0.00  0.00    +0.038 C 
BRANCH  25  26
ATOM     26  C   LIG    1        6.243  -1.058  -1.113  0.00  0.00    -0.029 A 
ATOM     27  C   LIG    1        7.043  -0.025  -1.592  0.00  0.00    +0.114 A 
ATOM     28  N   LIG    1        8.386   0.023  -1.453  0.00  0.00    -0.263 NA
ATOM     29  C   LIG    1        8.964  -1.008  -0.800  0.00  0.00    +0.111 A 
ATOM     30  C   LIG    1        8.261  -2.081  -0.279  0.00  0.00    +0.020 A 
ATOM     31  C   LIG    1        6.879  -2.103  -0.438  0.00  0.00    +0.006 A 
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  21  23
ENDBRANCH   7  21
TORSDOF 11