REMARK VINA RESULT: -5.6 1.672 4.263 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 12.711 41.017 25.034 0.00 0.00 0.055 A ATOM 2 C UNL d 1 12.719 40.831 26.425 0.00 0.00 0.055 A ATOM 3 C UNL d 1 12.075 40.082 24.204 0.00 0.00 0.018 A ATOM 4 C UNL d 1 12.145 39.668 26.960 0.00 0.00 0.018 A ATOM 5 C UNL d 1 11.491 38.938 24.751 0.00 0.00 0.001 A ATOM 6 C UNL d 1 11.538 38.723 26.126 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 13.332 41.787 27.377 0.00 0.00 0.294 C ATOM 8 O UNL d 1 14.386 41.562 27.953 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 12.531 42.865 27.543 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 13.023 43.884 28.428 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 13.038 45.183 27.671 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 12.180 46.224 28.047 0.00 0.00 0.009 A ATOM 13 C UNL d 1 12.020 47.335 27.220 0.00 0.00 0.001 A ATOM 14 C UNL d 1 12.724 47.416 26.020 0.00 0.00 0.000 A ATOM 15 C UNL d 1 13.627 46.415 25.669 0.00 0.00 0.001 A ATOM 16 C UNL d 1 13.791 45.304 26.496 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 13.442 42.115 24.359 0.00 0.00 0.294 C ATOM 18 O UNL d 1 12.918 43.139 23.965 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 14.707 41.695 24.139 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 15.745 42.684 24.105 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 16.515 42.590 25.419 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 17.150 43.935 25.778 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 17.134 44.208 27.271 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9