REMARK  Name = LIG001120
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -4.014   0.471   0.174  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -3.714  -0.430  -0.833  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -4.477  -1.100  -1.498  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -2.252  -0.475  -0.940  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -1.719   0.335   0.056  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1       -0.345   0.466   0.196  0.00  0.00    +0.028 A 
ATOM      7  C   LIG    1        0.503  -0.205  -0.702  0.00  0.00    +0.028 A 
ATOM      8  C   LIG    1       -0.077  -1.052  -1.678  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1       -1.462  -1.188  -1.815  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -2.818   0.930   0.868  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -8.612  -1.542  -0.539  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -7.642  -0.864  -0.207  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -6.960  -1.148   0.947  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -7.269  -1.973   1.440  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -5.849  -0.527   1.458  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -5.270  -0.988   2.442  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -5.343   0.715   0.724  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -6.363   1.309  -0.245  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -7.143   0.283  -1.047  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  N   LIG    1        1.899  -0.195  -0.595  0.00  0.00    -0.338 N 
ATOM     21  H   LIG    1        2.342  -0.368  -1.497  0.00  0.00    +0.146 HD
BRANCH  20  22
ATOM     22  C   LIG    1        2.564   0.906   0.105  0.00  0.00    +0.157 C 
BRANCH  22  23
ATOM     23  C   LIG    1        4.070   0.760  -0.007  0.00  0.00    +0.059 A 
ATOM     24  N   LIG    1        4.727   1.630  -0.814  0.00  0.00    -0.258 NA
ATOM     25  C   LIG    1        6.068   1.480  -0.923  0.00  0.00    +0.119 A 
ATOM     26  C   LIG    1        6.813   0.495  -0.272  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        6.111  -0.404   0.552  0.00  0.00    -0.015 A 
ATOM     28  C   LIG    1        6.820  -1.415   1.221  0.00  0.00    +0.008 A 
ATOM     29  C   LIG    1        8.204  -1.529   1.076  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1        8.897  -0.637   0.261  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1        8.207   0.372  -0.411  0.00  0.00    +0.010 A 
ATOM     32  C   LIG    1        4.723  -0.265   0.679  0.00  0.00    +0.033 A 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   7  20
TORSDOF 4