REMARK VINA RESULT: -5.0 0.000 0.000 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 -3.650 -4.888 8.644 0.00 0.00 -0.266 OA ATOM 2 N UNL d 1 -3.307 -6.826 7.437 0.00 0.00 -0.290 N ATOM 3 C UNL d 1 -3.084 -5.487 7.733 0.00 0.00 0.265 C ATOM 4 H UNL d 1 -3.029 -7.199 6.532 0.00 0.00 0.183 HD ENDROOT BRANCH 3 5 ATOM 5 C UNL d 1 -2.103 -4.787 6.863 0.00 0.00 0.036 A ATOM 6 C UNL d 1 -1.244 -5.504 6.030 0.00 0.00 0.036 A ATOM 7 C UNL d 1 -0.339 -4.788 5.269 0.00 0.00 0.117 A ATOM 8 N UNL d 1 -0.246 -3.442 5.287 0.00 0.00 -0.273 NA ATOM 9 C UNL d 1 -1.082 -2.777 6.116 0.00 0.00 0.117 A ATOM 10 C UNL d 1 -2.018 -3.398 6.921 0.00 0.00 0.036 A ENDBRANCH 3 5 BRANCH 2 11 ATOM 11 N UNL d 1 -4.246 -7.554 8.198 0.00 0.00 -0.247 NA ATOM 12 H UNL d 1 -5.175 -7.366 7.813 0.00 0.00 0.143 HD ATOM 13 H UNL d 1 -4.089 -8.552 7.990 0.00 0.00 0.143 HD ENDBRANCH 2 11 TORSDOF 2