REMARK VINA RESULT: -7.5 1.838 2.612 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 1 113.609 84.332 52.498 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 112.429 83.905 51.649 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 112.530 83.854 50.250 0.00 0.00 0.010 A ATOM 4 C UNL d 1 111.424 83.509 49.466 0.00 0.00 0.037 A ATOM 5 C UNL d 1 110.211 83.222 50.082 0.00 0.00 0.065 A ATOM 6 C UNL d 1 110.092 83.256 51.464 0.00 0.00 0.037 A ATOM 7 C UNL d 1 111.198 83.592 52.248 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 109.101 82.903 49.358 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 108.342 82.849 49.963 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 113.766 85.834 52.590 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 112.671 86.682 52.362 0.00 0.00 0.010 A ATOM 12 C UNL d 1 112.832 88.071 52.353 0.00 0.00 0.037 A ATOM 13 C UNL d 1 114.089 88.616 52.585 0.00 0.00 0.065 A ATOM 14 C UNL d 1 115.178 87.798 52.855 0.00 0.00 0.037 A ATOM 15 C UNL d 1 115.020 86.410 52.851 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 114.294 89.965 52.557 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 115.209 90.139 52.832 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4