REMARK  Name = LIG000274
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.058  -0.309  -0.388  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -2.576  -0.116   0.899  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -3.204  -0.037   1.937  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.118   0.002   0.791  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -0.778  -0.030  -0.555  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1        0.550   0.073  -0.943  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1        1.554   0.207   0.040  0.00  0.00    +0.033 A 
ATOM      8  C   LIG    1        1.168   0.230   1.399  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1       -0.175   0.132   1.787  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -2.009  -0.157  -1.387  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -8.478   0.684  -0.397  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -7.285   0.397  -0.417  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -6.326   1.370  -0.551  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -6.665   2.321  -0.598  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -4.978   1.202  -0.769  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -4.273   2.165  -1.067  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -4.469  -0.248  -0.755  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -5.371  -1.127   0.112  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -6.801  -1.034  -0.396  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  N   LIG    1        2.892   0.301  -0.392  0.00  0.00    -0.301 N 
ATOM     21  H   LIG    1        3.003   0.298  -1.397  0.00  0.00    +0.153 HD
BRANCH  20  22
ATOM     22  C   LIG    1        4.040   0.431   0.357  0.00  0.00    +0.135 C 
ATOM     23  C   LIG    1        5.375   0.548  -0.355  0.00  0.00    +0.128 C 
ATOM     24  C   LIG    1        6.245   0.501   0.867  0.00  0.00    +0.078 C 
ATOM     25  C   LIG    1        7.696   0.310   0.719  0.00  0.00    +0.026 C 
ATOM     26  C   LIG    1        8.066  -0.377  -0.374  0.00  0.00    +0.002 C 
ATOM     27  C   LIG    1        7.102  -0.923  -1.315  0.00  0.00    -0.003 C 
ATOM     28  N   LIG    1        5.582   0.594   1.971  0.00  0.00    -0.152 NA
ATOM     29  C   LIG    1        5.819  -0.516  -1.312  0.00  0.00    -0.010 C 
ATOM     30  N   LIG    1        4.190   0.532   1.645  0.00  0.00    -0.137 NA
ENDBRANCH  20  22
ENDBRANCH   7  20
TORSDOF 3