REMARK VINA RESULT: -6.0 0.000 0.000 REMARK 2 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_2 and C_12 REMARK 2 A between atoms: O_2 and C_15 REMARK I between atoms: N_4 and C_15 ROOT ATOM 1 O UNL d 1 -1.499 1.504 8.873 0.00 0.00 -0.337 OA ATOM 2 C UNL d 1 -0.446 0.499 8.848 0.00 0.00 0.065 C ATOM 3 C UNL d 1 -1.076 -0.904 9.012 0.00 0.00 0.079 C ATOM 4 C UNL d 1 -2.463 -0.532 9.368 0.00 0.00 -0.019 A ATOM 5 C UNL d 1 -2.635 0.839 9.257 0.00 0.00 0.110 A ATOM 6 C UNL d 1 0.520 0.815 9.995 0.00 0.00 0.046 C ATOM 7 C UNL d 1 0.277 0.625 7.505 0.00 0.00 0.046 C ATOM 8 C UNL d 1 -3.517 -1.357 9.723 0.00 0.00 0.010 A ATOM 9 C UNL d 1 -3.860 1.435 9.506 0.00 0.00 0.114 A ATOM 10 C UNL d 1 -4.763 -0.773 9.963 0.00 0.00 0.003 A ATOM 11 C UNL d 1 -4.940 0.616 9.844 0.00 0.00 0.040 A ENDROOT BRANCH 9 12 ATOM 12 O UNL d 1 -3.961 2.829 9.328 0.00 0.00 -0.259 OA BRANCH 12 13 ATOM 13 C UNL d 1 -4.887 3.386 8.454 0.00 0.00 0.365 C ATOM 14 O UNL d 1 -5.035 3.097 7.273 0.00 0.00 -0.238 OA ATOM 15 N UNL d 1 -5.676 4.346 9.027 0.00 0.00 -0.341 N ATOM 16 C UNL d 1 -5.676 4.769 10.404 0.00 0.00 0.151 C ATOM 17 H UNL d 1 -6.339 4.760 8.385 0.00 0.00 0.164 HD ENDBRANCH 12 13 ENDBRANCH 9 12 TORSDOF 2