REMARK  Name = LIG001608
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.083  -0.622  -0.848  0.00  0.00    -0.222 N 
ATOM      2  C   LIG    1       -0.806  -0.287  -0.494  0.00  0.00    +0.256 C 
ATOM      3  O   LIG    1       -0.406   0.356   0.460  0.00  0.00    -0.269 OA
ATOM      4  C   LIG    1        0.083  -0.870  -1.497  0.00  0.00    +0.071 A 
ATOM      5  C   LIG    1       -0.710  -1.558  -2.398  0.00  0.00    +0.051 A 
ATOM      6  C   LIG    1       -0.175  -2.224  -3.481  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        1.212  -2.171  -3.634  0.00  0.00    +0.003 A 
ATOM      8  C   LIG    1        2.022  -1.468  -2.711  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1        1.463  -0.806  -1.612  0.00  0.00    +0.047 A 
ATOM     10  C   LIG    1       -2.097  -1.420  -1.961  0.00  0.00    +0.255 C 
ATOM     11  O   LIG    1       -3.048  -1.932  -2.519  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1       -5.345   0.502   3.416  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -4.746   0.252   2.375  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1       -4.110  -0.952   2.194  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -4.116  -1.574   2.992  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -3.276  -1.313   1.160  0.00  0.00    +0.240 C 
ATOM     17  O   LIG    1       -2.625  -2.355   1.218  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1       -3.271  -0.370  -0.047  0.00  0.00    +0.171 C 
ATOM     19  C   LIG    1       -3.419   1.075   0.419  0.00  0.00    +0.041 C 
ATOM     20  C   LIG    1       -4.710   1.216   1.211  0.00  0.00    +0.098 C 
ENDBRANCH   1  18
BRANCH   9  21
ATOM     21  N   LIG    1        2.194  -0.094  -0.636  0.00  0.00    -0.281 N 
ATOM     22  H   LIG    1        1.627   0.279   0.125  0.00  0.00    +0.155 HD
ATOM     23  C   LIG    1        3.564   0.072  -0.566  0.00  0.00    +0.250 C 
ATOM     24  O   LIG    1        4.384  -0.402  -1.344  0.00  0.00    -0.270 OA
BRANCH  23  25
ATOM     25  C   LIG    1        4.061   0.884   0.576  0.00  0.00    +0.055 A 
ATOM     26  C   LIG    1        5.369   0.691   1.005  0.00  0.00    +0.123 A 
ATOM     27  N   LIG    1        5.938   1.365   2.037  0.00  0.00    -0.263 NA
ATOM     28  C   LIG    1        5.170   2.284   2.658  0.00  0.00    +0.111 A 
ATOM     29  C   LIG    1        3.862   2.563   2.296  0.00  0.00    +0.020 A 
ATOM     30  C   LIG    1        3.299   1.854   1.234  0.00  0.00    +0.016 A 
ENDBRANCH  23  25
ENDBRANCH   9  21
TORSDOF 3