REMARK VINA RESULT: -3.9 1.660 4.323 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 38.268 -41.218 -44.666 0.00 0.00 0.055 C ATOM 2 C UNL d 1 39.135 -41.008 -45.747 0.00 0.00 0.055 C ATOM 3 C UNL d 1 37.379 -42.308 -44.694 0.00 0.00 0.018 C ATOM 4 C UNL d 1 38.970 -41.769 -46.914 0.00 0.00 0.018 C ATOM 5 C UNL d 1 37.266 -43.100 -45.836 0.00 0.00 0.001 C ATOM 6 C UNL d 1 38.026 -42.799 -46.963 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 38.069 -40.251 -43.556 0.00 0.00 0.294 C ATOM 8 O UNL d 1 38.850 -40.152 -42.625 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 36.813 -39.745 -43.618 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 36.648 -38.366 -44.011 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 36.176 -38.179 -45.451 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 35.137 -37.076 -45.633 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 34.991 -36.146 -44.431 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 40.227 -40.017 -45.723 0.00 0.00 0.294 C ATOM 15 O UNL d 1 41.265 -40.168 -45.103 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 39.839 -38.898 -46.389 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 39.892 -37.658 -45.659 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 39.254 -36.501 -46.428 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 38.619 -35.450 -45.518 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 38.038 -34.290 -46.316 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10