REMARK  Name = LIG001435
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.681   0.570  -0.275  0.00  0.00    -0.198 N 
ATOM      2  C   LIG    1       -2.688   1.178   0.471  0.00  0.00    +0.278 A 
ATOM      3  O   LIG    1       -2.745   2.328   0.897  0.00  0.00    -0.265 OA
ATOM      4  C   LIG    1       -1.518   0.354   0.752  0.00  0.00    +0.068 A 
ATOM      5  C   LIG    1       -1.561  -0.950   0.289  0.00  0.00    +0.100 A 
ATOM      6  C   LIG    1       -0.458  -1.773   0.532  0.00  0.00    +0.031 A 
ATOM      7  C   LIG    1        0.658  -1.291   1.225  0.00  0.00    +0.007 A 
ATOM      8  C   LIG    1        0.690   0.029   1.697  0.00  0.00    -0.029 A 
ATOM      9  N   LIG    1       -2.660  -1.473  -0.399  0.00  0.00    -0.131 NA
ATOM     10  C   LIG    1       -0.411   0.857   1.449  0.00  0.00    +0.020 A 
ATOM     11  N   LIG    1       -3.640  -0.743  -0.655  0.00  0.00    -0.061 NA
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1       -8.078  -1.296  -1.146  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -7.176  -0.486  -0.951  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1       -6.562   0.150  -2.000  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -6.882  -0.118  -2.921  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -5.444   0.952  -1.967  0.00  0.00    +0.244 C 
ATOM     17  O   LIG    1       -4.884   1.277  -3.013  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1       -4.899   1.317  -0.587  0.00  0.00    +0.199 C 
ATOM     19  C   LIG    1       -5.976   1.175   0.491  0.00  0.00    +0.046 C 
ATOM     20  C   LIG    1       -6.648  -0.188   0.431  0.00  0.00    +0.099 C 
ENDBRANCH   1  18
BRANCH   8  21
ATOM     21  C   LIG    1        1.907   0.557   2.416  0.00  0.00    +0.141 C 
BRANCH  21  22
ATOM     22  N   LIG    1        2.925   0.974   1.478  0.00  0.00    -0.295 N 
ATOM     23  H   LIG    1        2.641   1.646   0.780  0.00  0.00    +0.151 HD
ATOM     24  C   LIG    1        3.891   0.087   1.059  0.00  0.00    +0.304 C 
ATOM     25  N   LIG    1        4.676   0.656   0.077  0.00  0.00    -0.267 N 
ATOM     26  H   LIG    1        4.937   1.607   0.312  0.00  0.00    +0.156 HD
ATOM     27  O   LIG    1        4.043  -1.029   1.538  0.00  0.00    -0.252 OA
BRANCH  25  28
ATOM     28  C   LIG    1        5.678  -0.080  -0.615  0.00  0.00    +0.072 A 
ATOM     29  C   LIG    1        5.445  -1.328  -1.222  0.00  0.00    +0.064 A 
ATOM     30 CL   LIG    1        3.866  -2.030  -1.359  0.00  0.00    -0.082 Cl
ATOM     31  C   LIG    1        6.488  -2.007  -1.866  0.00  0.00    +0.022 A 
ATOM     32  C   LIG    1        7.762  -1.444  -1.939  0.00  0.00    +0.003 A 
ATOM     33  C   LIG    1        7.994  -0.187  -1.388  0.00  0.00    +0.022 A 
ATOM     34  C   LIG    1        6.957   0.494  -0.743  0.00  0.00    +0.064 A 
ATOM     35 CL   LIG    1        7.304   2.056  -0.079  0.00  0.00    -0.082 Cl
ENDBRANCH  25  28
ENDBRANCH  21  22
ENDBRANCH   8  21
TORSDOF 4