REMARK VINA RESULT: -7.3 1.754 4.846 REMARK 9 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_7 REMARK 2 A between atoms: O_1 and C_11 REMARK 3 A between atoms: O_2 and C_13 REMARK 4 A between atoms: O_2 and C_16 REMARK 5 A between atoms: C_5 and C_6 REMARK 6 A between atoms: C_5 and C_7 REMARK 7 A between atoms: C_8 and C_11 REMARK 8 A between atoms: C_9 and C_16 REMARK 9 A between atoms: C_13 and C_14 ROOT ATOM 1 C UNL d 1 -5.256 -2.049 3.911 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -4.795 -1.964 2.588 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -4.342 -2.029 4.975 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -3.413 -1.931 2.349 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -2.970 -1.976 4.724 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -2.505 -1.942 3.412 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -5.691 -1.939 1.408 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -6.188 -0.909 0.978 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -5.910 -3.195 0.955 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -6.034 -3.338 -0.469 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -4.769 -3.971 -0.979 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -4.784 -5.291 -1.448 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -3.588 -5.958 -1.704 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -2.372 -5.308 -1.504 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -2.349 -3.975 -1.099 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -3.545 -3.304 -0.845 0.00 0.00 0.009 A ENDBRANCH 10 11 ENDBRANCH 9 10 ENDBRANCH 7 9 ENDBRANCH 2 7 BRANCH 1 17 ATOM 17 C UNL d 1 -6.679 -2.268 4.262 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -7.609 -1.717 3.704 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -6.717 -3.037 5.371 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -7.757 -2.784 6.326 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -8.790 -3.898 6.190 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -10.109 -3.356 5.635 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -10.971 -4.440 5.014 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9