REMARK VINA RESULT: -5.9 0.000 0.000 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 11.680 3.405 -11.316 0.00 0.00 0.055 A ATOM 2 C UNL d 1 11.941 3.372 -9.938 0.00 0.00 0.055 A ATOM 3 C UNL d 1 12.682 3.809 -12.211 0.00 0.00 0.018 A ATOM 4 C UNL d 1 13.186 3.815 -9.469 0.00 0.00 0.018 A ATOM 5 C UNL d 1 13.924 4.229 -11.732 0.00 0.00 0.001 A ATOM 6 C UNL d 1 14.172 4.246 -10.362 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 10.954 2.921 -8.927 0.00 0.00 0.294 C ATOM 8 O UNL d 1 10.221 3.693 -8.328 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 11.049 1.584 -8.741 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 11.614 1.161 -7.490 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 12.825 0.324 -7.792 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 14.109 0.848 -7.593 0.00 0.00 0.009 A ATOM 13 C UNL d 1 15.226 0.175 -8.082 0.00 0.00 0.001 A ATOM 14 C UNL d 1 15.069 -1.031 -8.762 0.00 0.00 0.000 A ATOM 15 C UNL d 1 13.801 -1.592 -8.909 0.00 0.00 0.001 A ATOM 16 C UNL d 1 12.682 -0.921 -8.418 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 10.344 3.130 -11.896 0.00 0.00 0.294 C ATOM 18 O UNL d 1 10.030 2.074 -12.410 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 9.643 4.284 -11.881 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 9.659 5.093 -13.065 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 9.751 6.551 -12.628 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 11.183 6.914 -12.229 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 11.335 7.135 -10.735 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9