REMARK VINA RESULT: -7.7 2.754 3.564 REMARK 4 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_14 REMARK 2 A between atoms: O_2 and C_15 REMARK 3 A between atoms: C_3 and C_4 REMARK 4 A between atoms: C_3 and C_5 ROOT ATOM 1 C UNL d 1 -1.810 -4.889 5.664 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -0.481 -5.613 5.589 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -0.225 -6.732 6.396 0.00 0.00 0.010 A ATOM 4 C UNL d 1 1.021 -7.368 6.363 0.00 0.00 0.037 A ATOM 5 C UNL d 1 2.017 -6.877 5.526 0.00 0.00 0.065 A ATOM 6 C UNL d 1 1.782 -5.779 4.712 0.00 0.00 0.037 A ATOM 7 C UNL d 1 0.535 -5.148 4.738 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 3.253 -7.450 5.476 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 3.548 -7.467 4.550 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 -2.743 -5.459 6.709 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 -3.053 -6.829 6.720 0.00 0.00 0.010 A ATOM 12 C UNL d 1 -3.987 -7.344 7.624 0.00 0.00 0.037 A ATOM 13 C UNL d 1 -4.605 -6.491 8.530 0.00 0.00 0.065 A ATOM 14 C UNL d 1 -4.283 -5.140 8.566 0.00 0.00 0.037 A ATOM 15 C UNL d 1 -3.359 -4.623 7.654 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 -5.543 -6.948 9.410 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 -6.250 -7.380 8.903 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4