REMARK VINA RESULT: -2.9 2.256 2.743 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 -6.485 -15.701 2.660 0.00 0.00 -0.266 OA ATOM 2 N UNL d 1 -5.727 -17.668 3.603 0.00 0.00 -0.290 N ATOM 3 C UNL d 1 -5.657 -16.306 3.336 0.00 0.00 0.265 C ATOM 4 H UNL d 1 -4.901 -18.165 3.929 0.00 0.00 0.183 HD ENDROOT BRANCH 3 5 ATOM 5 C UNL d 1 -4.490 -15.592 3.919 0.00 0.00 0.036 A ATOM 6 C UNL d 1 -3.243 -15.625 3.294 0.00 0.00 0.036 A ATOM 7 C UNL d 1 -2.198 -14.962 3.906 0.00 0.00 0.117 A ATOM 8 N UNL d 1 -2.319 -14.284 5.066 0.00 0.00 -0.273 NA ATOM 9 C UNL d 1 -3.537 -14.282 5.655 0.00 0.00 0.117 A ATOM 10 C UNL d 1 -4.644 -14.919 5.129 0.00 0.00 0.036 A ENDBRANCH 3 5 BRANCH 2 11 ATOM 11 N UNL d 1 -6.788 -18.423 3.060 0.00 0.00 -0.247 NA ATOM 12 H UNL d 1 -6.410 -19.325 2.760 0.00 0.00 0.143 HD ATOM 13 H UNL d 1 -7.412 -18.665 3.845 0.00 0.00 0.143 HD ENDBRANCH 2 11 TORSDOF 2