REMARK VINA RESULT: -5.3 1.279 3.934 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 10.074 -4.663 -5.934 0.00 0.00 0.055 A ATOM 2 C UNL d 1 10.040 -5.385 -4.730 0.00 0.00 0.055 A ATOM 3 C UNL d 1 10.715 -3.417 -5.987 0.00 0.00 0.018 A ATOM 4 C UNL d 1 10.593 -4.811 -3.576 0.00 0.00 0.018 A ATOM 5 C UNL d 1 11.278 -2.866 -4.835 0.00 0.00 0.001 A ATOM 6 C UNL d 1 11.205 -3.555 -3.627 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 9.420 -6.724 -4.595 0.00 0.00 0.294 C ATOM 8 O UNL d 1 9.701 -7.660 -5.328 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 8.486 -6.714 -3.615 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 7.655 -7.882 -3.525 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 6.574 -7.600 -2.519 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 5.412 -8.382 -2.499 0.00 0.00 0.009 A ATOM 13 C UNL d 1 4.315 -7.990 -1.735 0.00 0.00 0.001 A ATOM 14 C UNL d 1 4.376 -6.822 -0.978 0.00 0.00 0.000 A ATOM 15 C UNL d 1 5.550 -6.072 -0.942 0.00 0.00 0.001 A ATOM 16 C UNL d 1 6.650 -6.463 -1.704 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 9.365 -5.099 -7.160 0.00 0.00 0.294 C ATOM 18 O UNL d 1 9.921 -5.366 -8.208 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 8.039 -4.986 -6.932 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 7.144 -5.648 -7.838 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 7.085 -7.118 -7.436 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 7.838 -7.992 -8.441 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 8.685 -9.057 -7.769 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9