REMARK VINA RESULT: -4.6 1.934 3.607 REMARK 10 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_9 REMARK 2 A between atoms: O_1 and C_15 REMARK 3 A between atoms: O_2 and C_10 REMARK 4 A between atoms: O_2 and C_16 REMARK 5 A between atoms: C_5 and C_7 REMARK 6 A between atoms: C_5 and C_9 REMARK 7 A between atoms: C_6 and C_8 REMARK 8 A between atoms: C_6 and C_10 REMARK 9 A between atoms: C_11 and C_15 REMARK 10 A between atoms: C_12 and C_16 ROOT ATOM 1 C UNL d 1 14.586 44.930 25.793 0.00 0.00 0.055 C ATOM 2 C UNL d 1 14.720 44.321 27.048 0.00 0.00 0.055 C ATOM 3 C UNL d 1 15.709 45.034 24.952 0.00 0.00 0.018 C ATOM 4 C UNL d 1 16.001 44.000 27.521 0.00 0.00 0.018 C ATOM 5 C UNL d 1 16.972 44.653 25.406 0.00 0.00 0.001 C ATOM 6 C UNL d 1 17.125 44.183 26.708 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 13.376 45.667 25.348 0.00 0.00 0.294 C ATOM 8 O UNL d 1 12.574 45.193 24.561 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 13.473 46.965 25.723 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 13.256 47.986 24.727 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 14.516 48.397 23.969 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 14.623 47.810 22.564 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 16.056 47.596 22.080 0.00 0.00 0.005 C ENDBRANCH 11 12 ENDBRANCH 10 11 ENDBRANCH 9 10 ENDBRANCH 7 9 ENDBRANCH 1 7 BRANCH 2 14 ATOM 14 C UNL d 1 13.570 43.994 27.911 0.00 0.00 0.294 C ATOM 15 O UNL d 1 13.334 44.553 28.968 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 12.910 42.921 27.400 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 13.375 41.621 27.806 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 13.326 40.602 26.668 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 13.650 41.208 25.302 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 15.152 41.257 25.050 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10