REMARK  Name = LIG001936
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.323  -0.130  -0.651  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -1.081   0.294   0.455  0.00  0.00    +0.029 A 
ATOM      3  C   LIG    1       -2.461   0.341   0.342  0.00  0.00    -0.016 A 
ATOM      4  C   LIG    1       -3.489   0.732   1.348  0.00  0.00    +0.144 C 
ATOM      5  N   LIG    1       -4.731   0.642   0.592  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1       -4.530   0.105  -0.668  0.00  0.00    +0.248 C 
ATOM      7  O   LIG    1       -5.362  -0.235  -1.485  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -3.080  -0.033  -0.846  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1       -2.371  -0.462  -1.948  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -0.976  -0.506  -1.843  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -6.024   0.792   1.250  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -6.609  -0.580   1.587  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -6.032  -1.371   2.334  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -7.793  -0.922   0.987  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -8.158  -1.835   1.221  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -8.489  -0.243   0.023  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -9.530  -0.708  -0.436  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -7.913   1.063  -0.462  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -7.014   1.730   0.564  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  21
ATOM     20  C   LIG    1        2.027  -0.468  -1.439  0.00  0.00    +0.248 C 
ATOM     21  N   LIG    1        1.077  -0.165  -0.486  0.00  0.00    -0.282 N 
ATOM     22  H   LIG    1        1.424   0.112   0.424  0.00  0.00    +0.155 HD
ATOM     23  O   LIG    1        1.846  -0.691  -2.628  0.00  0.00    -0.270 OA
BRANCH  20  28
ATOM     24  C   LIG    1        7.379   0.007   0.345  0.00  0.00    +0.162 A 
ATOM     25  C   LIG    1        6.035  -0.107  -0.050  0.00  0.00    +0.169 A 
ATOM     26  O   LIG    1        5.602   0.694  -1.082  0.00  0.00    -0.483 OA
ATOM     27  C   LIG    1        4.432   0.240  -1.782  0.00  0.00    +0.270 C 
ATOM     28  C   LIG    1        3.416  -0.433  -0.911  0.00  0.00    +0.052 C 
ATOM     29  C   LIG    1        3.754  -1.034   0.238  0.00  0.00    +0.023 C 
ATOM     30  C   LIG    1        5.159  -0.968   0.630  0.00  0.00    +0.021 A 
ATOM     31  C   LIG    1        5.634  -1.732   1.698  0.00  0.00    +0.012 A 
ATOM     32  C   LIG    1        6.971  -1.635   2.084  0.00  0.00    +0.004 A 
ATOM     33  C   LIG    1        7.839  -0.769   1.413  0.00  0.00    +0.049 A 
BRANCH  24  35
ATOM     34  C   LIG    1        9.511   1.023   0.001  0.00  0.00    +0.277 C 
ATOM     35  O   LIG    1        8.147   0.888  -0.372  0.00  0.00    -0.491 OA
ENDBRANCH  24  35
ENDBRANCH  20  28
ENDBRANCH   1  21
TORSDOF 4