REMARK  Name = LIG001718
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.377   1.335  -1.064  0.00  0.00    +0.027 A 
ATOM      2  C   LIG    1        1.149   0.848  -0.590  0.00  0.00    +0.050 A 
ATOM      3  C   LIG    1        1.143   0.142   0.623  0.00  0.00    +0.071 A 
ATOM      4  C   LIG    1        2.298  -0.038   1.382  0.00  0.00    +0.089 A 
ATOM      5  N   LIG    1        2.035  -0.756   2.521  0.00  0.00    -0.236 NA
ATOM      6  C   LIG    1        0.747  -0.999   2.485  0.00  0.00    +0.201 A 
ATOM      7  C   LIG    1        3.509   0.505   0.934  0.00  0.00    +0.031 A 
ATOM      8  N   LIG    1        0.162  -0.486   1.357  0.00  0.00    -0.318 N 
ATOM      9  C   LIG    1        3.526   1.206  -0.279  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   8  10
ATOM     10  C   LIG    1       -1.242  -0.665   1.009  0.00  0.00    +0.175 C 
ATOM     11  C   LIG    1       -1.960   0.661   0.801  0.00  0.00    +0.242 C 
ATOM     12  O   LIG    1       -1.773   1.653   1.501  0.00  0.00    -0.273 OA
ATOM     13  N   LIG    1       -2.928   0.686  -0.177  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -3.416   1.567  -0.284  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -3.509  -0.388  -0.803  0.00  0.00    +0.219 C 
ATOM     16  O   LIG    1       -4.526  -0.257  -1.476  0.00  0.00    -0.275 OA
ATOM     17  C   LIG    1       -2.882  -1.736  -0.539  0.00  0.00    +0.099 C 
ATOM     18  C   LIG    1       -1.409  -1.595  -0.196  0.00  0.00    +0.044 C 
ENDBRANCH   8  10
BRANCH   1  19
ATOM     19  N   LIG    1        2.406   2.139  -2.213  0.00  0.00    -0.358 N 
ATOM     20  H   LIG    1        3.321   2.202  -2.647  0.00  0.00    +0.142 HD
ATOM     21  H   LIG    1        1.672   1.936  -2.883  0.00  0.00    +0.142 HD
ENDBRANCH   1  19
TORSDOF 2