REMARK VINA RESULT: -7.1 1.681 2.418 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 -1.309 -2.251 5.365 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -2.053 -3.287 5.952 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -0.161 -1.762 6.005 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -1.671 -3.771 7.212 0.00 0.00 0.018 A ATOM 5 C UNL d 1 0.219 -2.266 7.250 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -0.543 -3.260 7.861 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -3.254 -3.890 5.326 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -3.195 -4.850 4.573 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -4.362 -3.187 5.660 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -5.171 -2.730 4.565 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -5.903 -1.498 5.019 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -6.825 -1.576 6.071 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -7.671 -0.504 6.344 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -7.595 0.656 5.577 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -6.638 0.767 4.570 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -5.788 -0.303 4.296 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 -1.730 -1.551 4.128 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -1.560 -1.991 3.008 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -2.168 -0.323 4.479 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -2.125 0.712 3.486 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -0.705 1.270 3.461 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -0.186 1.508 4.881 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 0.487 2.859 5.037 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9