REMARK VINA RESULT:      -3.7      0.053      1.493
REMARK  2 active torsions:
REMARK  status: ('A' for Active; 'I' for Inactive)
REMARK    1  A    between atoms: N_2  and  N_4 
REMARK       I    between atoms: N_2  and  C_8 
REMARK    2  A    between atoms: C_5  and  C_8 
ROOT
ATOM      1  O   UNL d   1      36.696 -39.917 -43.417  0.00  0.00    -0.266 OA
ATOM      2  N   UNL d   1      38.713 -38.795 -43.454  0.00  0.00    -0.290 N 
ATOM      3  C   UNL d   1      37.391 -38.993 -43.831  0.00  0.00     0.265 C 
ATOM      4  H   UNL d   1      39.316 -38.194 -44.013  0.00  0.00     0.183 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   UNL d   1      36.838 -38.006 -44.797  0.00  0.00     0.036 A 
ATOM      6  C   UNL d   1      35.672 -37.296 -44.509  0.00  0.00     0.036 A 
ATOM      7  C   UNL d   1      35.201 -36.416 -45.464  0.00  0.00     0.117 A 
ATOM      8  N   UNL d   1      35.808 -36.206 -46.651  0.00  0.00    -0.273 NA
ATOM      9  C   UNL d   1      36.927 -36.919 -46.906  0.00  0.00     0.117 A 
ATOM     10  C   UNL d   1      37.477 -37.828 -46.022  0.00  0.00     0.036 A 
ENDBRANCH   3   5
BRANCH   2  11
ATOM     11  N   UNL d   1      39.320 -39.705 -42.564  0.00  0.00    -0.247 NA
ATOM     12  H   UNL d   1      38.652 -40.458 -42.381  0.00  0.00     0.143 HD
ATOM     13  H   UNL d   1      40.080 -40.169 -43.085  0.00  0.00     0.143 HD
ENDBRANCH   2  11
TORSDOF 2