REMARK VINA RESULT: -5.1 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 1.750 5.673 2.918 0.00 0.00 -0.266 OA ATOM 2 N UNL d 1 2.727 5.641 5.010 0.00 0.00 -0.290 N ATOM 3 C UNL d 1 2.648 5.294 3.667 0.00 0.00 0.265 C ATOM 4 H UNL d 1 3.318 5.102 5.639 0.00 0.00 0.183 HD ENDROOT BRANCH 3 5 ATOM 5 C UNL d 1 3.730 4.409 3.161 0.00 0.00 0.036 A ATOM 6 C UNL d 1 3.683 3.029 3.368 0.00 0.00 0.036 A ATOM 7 C UNL d 1 4.737 2.271 2.895 0.00 0.00 0.117 A ATOM 8 N UNL d 1 5.799 2.790 2.245 0.00 0.00 -0.273 NA ATOM 9 C UNL d 1 5.822 4.131 2.073 0.00 0.00 0.117 A ATOM 10 C UNL d 1 4.823 4.978 2.512 0.00 0.00 0.036 A ENDBRANCH 3 5 BRANCH 2 11 ATOM 11 N UNL d 1 1.722 6.454 5.573 0.00 0.00 -0.247 NA ATOM 12 H UNL d 1 0.847 5.923 5.565 0.00 0.00 0.143 HD ATOM 13 H UNL d 1 1.944 6.551 6.575 0.00 0.00 0.143 HD ENDBRANCH 2 11 TORSDOF 2