REMARK VINA RESULT: -5.1 1.869 4.763 REMARK 10 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_9 REMARK 2 A between atoms: O_1 and C_15 REMARK 3 A between atoms: O_2 and C_10 REMARK 4 A between atoms: O_2 and C_16 REMARK 5 A between atoms: C_5 and C_7 REMARK 6 A between atoms: C_5 and C_9 REMARK 7 A between atoms: C_6 and C_8 REMARK 8 A between atoms: C_6 and C_10 REMARK 9 A between atoms: C_11 and C_15 REMARK 10 A between atoms: C_12 and C_16 ROOT ATOM 1 C UNL d 1 9.770 -16.377 5.360 0.00 0.00 0.055 C ATOM 2 C UNL d 1 10.117 -15.087 5.784 0.00 0.00 0.055 C ATOM 3 C UNL d 1 9.604 -16.631 3.986 0.00 0.00 0.018 C ATOM 4 C UNL d 1 10.107 -14.035 4.858 0.00 0.00 0.018 C ATOM 5 C UNL d 1 9.658 -15.587 3.061 0.00 0.00 0.001 C ATOM 6 C UNL d 1 9.859 -14.283 3.504 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 9.361 -17.475 6.272 0.00 0.00 0.294 C ATOM 8 O UNL d 1 10.103 -18.399 6.559 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 8.023 -17.415 6.480 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 7.326 -18.634 6.812 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 6.713 -19.351 5.612 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 6.284 -18.422 4.478 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 6.781 -18.844 3.098 0.00 0.00 0.005 C ENDBRANCH 11 12 ENDBRANCH 10 11 ENDBRANCH 9 10 ENDBRANCH 7 9 ENDBRANCH 1 7 BRANCH 2 14 ATOM 14 C UNL d 1 10.500 -14.774 7.174 0.00 0.00 0.294 C ATOM 15 O UNL d 1 11.387 -15.351 7.779 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 9.648 -13.846 7.682 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 8.373 -14.326 8.150 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 7.201 -13.563 7.532 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 6.598 -14.266 6.316 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 5.076 -14.297 6.381 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10