REMARK VINA RESULT: -6.7 0.255 1.029 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 32.626 1.759 -42.713 0.00 0.00 0.055 A ATOM 2 C UNL d 1 31.314 2.196 -42.954 0.00 0.00 0.055 A ATOM 3 C UNL d 1 33.161 0.698 -43.459 0.00 0.00 0.018 A ATOM 4 C UNL d 1 30.531 1.513 -43.896 0.00 0.00 0.018 A ATOM 5 C UNL d 1 32.377 0.040 -44.407 0.00 0.00 0.001 A ATOM 6 C UNL d 1 31.058 0.436 -44.616 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 30.684 3.333 -42.241 0.00 0.00 0.294 C ATOM 8 O UNL d 1 30.091 3.201 -41.181 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 30.812 4.470 -42.963 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 31.103 5.661 -42.215 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 30.021 6.663 -42.508 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 28.730 6.227 -42.832 0.00 0.00 0.009 A ATOM 13 C UNL d 1 27.788 7.127 -43.326 0.00 0.00 0.001 A ATOM 14 C UNL d 1 28.127 8.469 -43.489 0.00 0.00 0.000 A ATOM 15 C UNL d 1 29.388 8.923 -43.109 0.00 0.00 0.001 A ATOM 16 C UNL d 1 30.331 8.025 -42.612 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 33.470 2.294 -41.619 0.00 0.00 0.294 C ATOM 18 O UNL d 1 33.307 3.385 -41.106 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 34.498 1.438 -41.434 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 34.316 0.365 -40.499 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 35.564 0.296 -39.625 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 35.258 0.753 -38.197 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 33.928 1.476 -38.088 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9