REMARK VINA RESULT: -7.3 1.933 5.577 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 -4.860 -3.717 4.438 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -3.514 -4.086 4.583 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -5.600 -4.179 3.340 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -2.908 -4.859 3.582 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -4.990 -4.964 2.361 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -3.641 -5.293 2.473 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -2.671 -3.676 5.731 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -2.778 -4.175 6.841 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -1.853 -2.658 5.376 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -2.080 -1.406 6.041 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -1.981 -0.314 5.012 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -2.915 -0.243 3.971 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -2.701 0.613 2.893 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -1.560 1.411 2.854 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -0.658 1.395 3.917 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -0.871 0.540 4.997 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 -5.541 -2.760 5.342 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -5.845 -3.010 6.493 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -5.879 -1.674 4.614 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -7.154 -1.067 4.869 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -6.923 0.427 5.068 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -6.398 1.075 3.784 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -7.321 2.159 3.258 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9