REMARK  Name = LIG001805
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.705  -0.079  -0.029  0.00  0.00    -0.289 N 
ATOM      2  C   LIG    1        1.474   1.301   0.110  0.00  0.00    +0.070 A 
ATOM      3  C   LIG    1        0.095   1.498   0.241  0.00  0.00    +0.071 A 
ATOM      4  C   LIG    1       -0.446   2.761   0.382  0.00  0.00    +0.028 A 
ATOM      5  C   LIG    1        0.439   3.844   0.395  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        1.826   3.646   0.266  0.00  0.00    +0.002 A 
ATOM      7  N   LIG    1       -0.527   0.242   0.187  0.00  0.00    -0.280 N 
ATOM      8  C   LIG    1        2.358   2.361   0.119  0.00  0.00    +0.028 A 
ATOM      9  C   LIG    1        0.460  -0.746  -0.024  0.00  0.00    +0.331 A 
ATOM     10  O   LIG    1        0.258  -1.940  -0.179  0.00  0.00    -0.246 OA
ENDROOT
BRANCH   7  11
ATOM     11  C   LIG    1       -1.953  -0.009   0.198  0.00  0.00    +0.179 C 
ATOM     12  C   LIG    1       -2.438  -0.381  -1.211  0.00  0.00    +0.242 C 
ATOM     13  O   LIG    1       -1.948   0.067  -2.247  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -3.562  -1.174  -1.270  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -3.897  -1.391  -2.199  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -4.338  -1.620  -0.231  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -5.394  -2.212  -0.436  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -3.874  -1.264   1.162  0.00  0.00    +0.099 C 
ATOM     19  C   LIG    1       -2.366  -1.078   1.210  0.00  0.00    +0.044 C 
ENDBRANCH   7  11
BRANCH   1  21
ATOM     20  C   LIG    1        3.303  -1.800   0.732  0.00  0.00    +0.031 C 
ATOM     21  C   LIG    1        2.995  -0.698  -0.284  0.00  0.00    +0.086 C 
ATOM     22  C   LIG    1        3.083  -1.234  -1.713  0.00  0.00    +0.031 C 
ENDBRANCH   1  21
TORSDOF 2