REMARK VINA RESULT: -4.1 1.897 6.098 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 18.927 -30.857 -2.308 0.00 0.00 0.055 A ATOM 2 C UNL d 1 18.340 -30.326 -3.466 0.00 0.00 0.055 A ATOM 3 C UNL d 1 19.895 -31.867 -2.411 0.00 0.00 0.018 A ATOM 4 C UNL d 1 18.684 -30.866 -4.714 0.00 0.00 0.018 A ATOM 5 C UNL d 1 20.242 -32.383 -3.660 0.00 0.00 0.001 A ATOM 6 C UNL d 1 19.628 -31.894 -4.810 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 17.340 -29.231 -3.451 0.00 0.00 0.294 C ATOM 8 O UNL d 1 17.542 -28.160 -2.900 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 16.198 -29.628 -4.060 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 15.285 -30.387 -3.252 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 15.449 -31.838 -3.613 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 15.787 -32.773 -2.626 0.00 0.00 0.009 A ATOM 13 C UNL d 1 16.165 -34.065 -2.984 0.00 0.00 0.001 A ATOM 14 C UNL d 1 16.196 -34.434 -4.328 0.00 0.00 0.000 A ATOM 15 C UNL d 1 15.800 -33.530 -5.311 0.00 0.00 0.001 A ATOM 16 C UNL d 1 15.420 -32.237 -4.955 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 18.501 -30.482 -0.938 0.00 0.00 0.294 C ATOM 18 O UNL d 1 17.469 -30.862 -0.419 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 19.367 -29.553 -0.477 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 20.277 -29.943 0.561 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 21.691 -29.648 0.071 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 22.552 -30.913 0.090 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 21.822 -32.107 0.676 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9