REMARK  Name = LIG000136
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.774  -1.454   0.177  0.00  0.00    -0.011 A 
ATOM      2  C   LIG    1       -0.483  -0.945   0.090  0.00  0.00    -0.010 A 
ATOM      3  C   LIG    1        0.029   0.413   0.443  0.00  0.00    +0.145 C 
ATOM      4  N   LIG    1        1.449   0.308   0.136  0.00  0.00    -0.282 N 
ATOM      5  C   LIG    1        1.794  -0.938  -0.349  0.00  0.00    +0.248 C 
ATOM      6  O   LIG    1        2.891  -1.337  -0.686  0.00  0.00    -0.270 OA
ATOM      7  C   LIG    1        0.565  -1.738  -0.376  0.00  0.00    +0.042 A 
ATOM      8  C   LIG    1        0.395  -3.050  -0.774  0.00  0.00    +0.013 A 
ATOM      9  C   LIG    1       -0.892  -3.579  -0.695  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -1.961  -2.792  -0.224  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   4  11
ATOM     11  C   LIG    1        2.347   1.445   0.291  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1        3.506   1.094   1.227  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1        3.340   0.844   2.421  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1        4.755   1.011   0.662  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        5.503   0.746   1.287  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        5.099   1.099  -0.662  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1        6.265   0.945  -1.018  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1        3.990   1.371  -1.650  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1        2.811   2.083  -1.014  0.00  0.00    +0.041 C 
ENDBRANCH   4  11
BRANCH   1  21
ATOM     20  C   LIG    1       -3.513   0.352  -0.122  0.00  0.00    +0.032 A 
ATOM     21  C   LIG    1       -2.897  -0.645   0.670  0.00  0.00    +0.003 A 
ATOM     22  C   LIG    1       -3.373  -0.868   1.976  0.00  0.00    +0.010 A 
ATOM     23  C   LIG    1       -4.403  -0.093   2.508  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1       -4.961   0.929   1.749  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1       -4.504   1.161   0.451  0.00  0.00    +0.023 A 
BRANCH  20  26
ATOM     26  N   LIG    1       -3.014   0.699  -1.395  0.00  0.00    -0.357 N 
ATOM     27  H   LIG    1       -3.706   1.153  -1.984  0.00  0.00    +0.142 HD
ATOM     28  H   LIG    1       -2.577  -0.087  -1.871  0.00  0.00    +0.142 HD
ENDBRANCH  20  26
ENDBRANCH   1  21
TORSDOF 3