REMARK  Name = LIG000899
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.138  -0.767  -0.242  0.00  0.00    +0.038 A 
ATOM      2  C   LIG    1       -1.948  -0.081  -0.040  0.00  0.00    +0.071 A 
ATOM      3  C   LIG    1       -0.568  -0.560  -0.139  0.00  0.00    +0.256 C 
ATOM      4  N   LIG    1        0.242   0.510   0.109  0.00  0.00    -0.222 N 
ATOM      5  C   LIG    1       -0.486   1.631   0.407  0.00  0.00    +0.256 C 
ATOM      6  O   LIG    1       -0.060   2.730   0.707  0.00  0.00    -0.269 OA
ATOM      7  O   LIG    1       -0.256  -1.706  -0.408  0.00  0.00    -0.269 OA
ATOM      8  C   LIG    1       -1.899   1.268   0.286  0.00  0.00    +0.069 A 
ATOM      9  C   LIG    1       -3.055   2.002   0.447  0.00  0.00    +0.054 A 
ATOM     10 CL   LIG    1       -3.061   3.672   0.841  0.00  0.00    -0.083 Cl
ATOM     11  C   LIG    1       -4.275   1.338   0.283  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1       -4.313  -0.035  -0.038  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   4  13
ATOM     13  C   LIG    1        1.690   0.451   0.253  0.00  0.00    +0.171 C 
ATOM     14  C   LIG    1        2.037  -0.210   1.591  0.00  0.00    +0.240 C 
ATOM     15  O   LIG    1        1.265  -0.270   2.546  0.00  0.00    -0.273 OA
ATOM     16  N   LIG    1        3.320  -0.699   1.698  0.00  0.00    -0.255 N 
ATOM     17  H   LIG    1        3.555  -1.127   2.583  0.00  0.00    +0.158 HD
ATOM     18  C   LIG    1        4.257  -0.826   0.703  0.00  0.00    +0.219 C 
ATOM     19  O   LIG    1        5.340  -1.364   0.917  0.00  0.00    -0.275 OA
ATOM     20  C   LIG    1        3.909  -0.221  -0.637  0.00  0.00    +0.098 C 
ATOM     21  C   LIG    1        2.408  -0.263  -0.888  0.00  0.00    +0.041 C 
ENDBRANCH   4  13
BRANCH   1  22
ATOM     22  N   LIG    1       -3.192  -2.148  -0.413  0.00  0.00    -0.357 N 
ATOM     23  H   LIG    1       -4.006  -2.510  -0.898  0.00  0.00    +0.142 HD
ATOM     24  H   LIG    1       -2.314  -2.571  -0.726  0.00  0.00    +0.142 HD
ENDBRANCH   1  22
TORSDOF 2