REMARK  Name = LIG001303
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.831   0.306  -0.002  0.00  0.00    -0.222 N 
ATOM      2  C   LIG    1        1.761   0.991   0.509  0.00  0.00    +0.255 C 
ATOM      3  O   LIG    1        1.750   1.931   1.281  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        0.561   0.384  -0.059  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1        0.966  -0.666  -0.858  0.00  0.00    +0.050 A 
ATOM      6  C   LIG    1        0.056  -1.449  -1.534  0.00  0.00    +0.015 A 
ATOM      7  C   LIG    1       -1.303  -1.134  -1.382  0.00  0.00    +0.024 A 
ATOM      8  C   LIG    1       -1.726  -0.061  -0.565  0.00  0.00    +0.034 A 
ATOM      9  C   LIG    1       -0.771   0.711   0.112  0.00  0.00    +0.037 A 
ATOM     10  C   LIG    1        2.424  -0.734  -0.794  0.00  0.00    +0.254 C 
ATOM     11  O   LIG    1        3.094  -1.587  -1.343  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1        8.104  -0.502   1.300  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1        6.947  -0.201   1.023  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1        5.892  -0.712   1.738  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        6.129  -1.387   2.452  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        4.547  -0.514   1.518  0.00  0.00    +0.240 C 
ATOM     17  O   LIG    1        3.711  -1.107   2.198  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1        4.195   0.527   0.451  0.00  0.00    +0.171 C 
ATOM     19  C   LIG    1        5.238   0.512  -0.663  0.00  0.00    +0.041 C 
ATOM     20  C   LIG    1        6.610   0.791  -0.067  0.00  0.00    +0.098 C 
ENDBRANCH   1  18
BRANCH   8  21
ATOM     21  N   LIG    1       -3.078   0.294  -0.373  0.00  0.00    -0.285 N 
ATOM     22  H   LIG    1       -3.249   1.072   0.253  0.00  0.00    +0.155 HD
ATOM     23  C   LIG    1       -4.203  -0.288  -0.936  0.00  0.00    +0.220 C 
ATOM     24  O   LIG    1       -4.188  -1.223  -1.736  0.00  0.00    -0.275 OA
BRANCH  23  25
ATOM     25  C   LIG    1       -5.516   0.387  -0.451  0.00  0.00    +0.075 C 
ATOM     26  C   LIG    1       -6.851  -0.381  -0.671  0.00  0.00    +0.013 C 
ATOM     27  C   LIG    1       -7.331   0.197   0.673  0.00  0.00    +0.001 C 
ATOM     28  C   LIG    1       -5.848   0.320   1.067  0.00  0.00    +0.013 C 
ENDBRANCH  23  25
ENDBRANCH   8  21
TORSDOF 3