REMARK  Name = LIG001138
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.739  -2.041   0.407  0.00  0.00    +0.152 A 
ATOM      2  C   LIG    1       -1.702  -3.026   0.133  0.00  0.00    +0.148 A 
ATOM      3  N   LIG    1       -1.636  -4.404   0.079  0.00  0.00    -0.231 NA
ATOM      4  C   LIG    1       -2.859  -4.785  -0.225  0.00  0.00    +0.201 A 
ATOM      5  N   LIG    1       -3.707  -3.718  -0.378  0.00  0.00    -0.312 N 
ATOM      6  C   LIG    1       -2.977  -2.581  -0.160  0.00  0.00    +0.167 A 
ATOM      7  N   LIG    1       -3.397  -1.310  -0.218  0.00  0.00    -0.195 NA
ATOM      8  C   LIG    1       -2.416  -0.432   0.048  0.00  0.00    +0.219 A 
ATOM      9  N   LIG    1       -1.137  -0.742   0.346  0.00  0.00    -0.197 NA
ENDROOT
BRANCH   5  10
ATOM     10  C   LIG    1       -5.122  -3.774  -0.713  0.00  0.00    +0.084 C 
ATOM     11  C   LIG    1       -5.349  -4.385  -2.096  0.00  0.00    +0.030 C 
ATOM     12  C   LIG    1       -5.927  -4.509   0.359  0.00  0.00    +0.030 C 
ENDBRANCH   5  10
BRANCH   1  13
ATOM     13  N   LIG    1        0.578  -2.386   0.729  0.00  0.00    -0.327 N 
ATOM     14  H   LIG    1        0.767  -3.343   0.438  0.00  0.00    +0.148 HD
BRANCH  13  15
ATOM     15  C   LIG    1        1.606  -1.406   0.426  0.00  0.00    +0.103 C 
BRANCH  15  16
ATOM     16  C   LIG    1        1.892  -0.542   1.657  0.00  0.00    +0.019 C 
BRANCH  16  17
ATOM     17  C   LIG    1        2.826   0.635   1.364  0.00  0.00    +0.002 C 
BRANCH  17  18
ATOM     18  C   LIG    1        4.231   0.205   0.936  0.00  0.00    +0.000 C 
BRANCH  18  19
ATOM     19  C   LIG    1        5.213   1.377   0.829  0.00  0.00    -0.000 C 
BRANCH  19  20
ATOM     20  C   LIG    1        4.838   2.380  -0.266  0.00  0.00    -0.000 C 
BRANCH  20  22
ATOM     21  C   LIG    1        6.155   4.355   0.669  0.00  0.00    +0.004 C 
ATOM     22  C   LIG    1        5.922   3.432  -0.517  0.00  0.00    -0.003 C 
ENDBRANCH  20  22
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH  13  15
ENDBRANCH   1  13
BRANCH   8  23
ATOM     23  N   LIG    1       -2.810   0.904  -0.011  0.00  0.00    -0.308 N 
ATOM     24  H   LIG    1       -3.667   0.873  -0.565  0.00  0.00    +0.149 HD
BRANCH  23  25
ATOM     25  CA  LIG    1       -1.825   1.819  -0.604  0.00  0.00    +0.098 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -0.958   2.444   0.504  0.00  0.00    +0.021 C 
ATOM     27  C   LIG    1        0.167   3.318  -0.033  0.00  0.00    +0.006 C 
ENDBRANCH  25  26
BRANCH  25  28
ATOM     28  C   LIG    1       -2.602   2.908  -1.381  0.00  0.00    +0.178 C 
BRANCH  28  29
ATOM     29  O   LIG    1       -3.479   2.295  -2.332  0.00  0.00    -0.393 OA
ATOM     30  H   LIG    1       -3.951   3.016  -2.784  0.00  0.00    +0.209 HD
ENDBRANCH  28  29
ENDBRANCH  25  28
ENDBRANCH  23  25
ENDBRANCH   8  23
TORSDOF 14