REMARK VINA RESULT: -5.5 2.023 7.484 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 31.763 3.919 -41.893 0.00 0.00 0.055 A ATOM 2 C UNL d 1 32.287 2.689 -42.321 0.00 0.00 0.055 A ATOM 3 C UNL d 1 32.432 4.663 -40.910 0.00 0.00 0.018 A ATOM 4 C UNL d 1 33.442 2.189 -41.703 0.00 0.00 0.018 A ATOM 5 C UNL d 1 33.592 4.162 -40.317 0.00 0.00 0.001 A ATOM 6 C UNL d 1 34.089 2.920 -40.702 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 31.667 1.858 -43.381 0.00 0.00 0.294 C ATOM 8 O UNL d 1 30.746 2.256 -44.078 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 32.221 0.624 -43.395 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 32.365 0.014 -44.688 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 33.831 -0.016 -45.021 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 34.784 -0.054 -43.995 0.00 0.00 0.009 A ATOM 13 C UNL d 1 36.132 0.151 -44.281 0.00 0.00 0.001 A ATOM 14 C UNL d 1 36.537 0.384 -45.593 0.00 0.00 0.000 A ATOM 15 C UNL d 1 35.605 0.360 -46.629 0.00 0.00 0.001 A ATOM 16 C UNL d 1 34.255 0.153 -46.346 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 30.457 4.448 -42.353 0.00 0.00 0.294 C ATOM 18 O UNL d 1 29.399 3.868 -42.202 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 30.695 5.564 -43.075 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 30.333 6.825 -42.496 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 28.949 7.194 -43.019 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 28.698 8.699 -42.891 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 29.477 9.509 -43.911 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9