REMARK VINA RESULT: -5.5 0.647 5.878 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 9.746 -15.306 6.756 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 10.145 -13.917 7.211 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 9.211 -12.869 7.227 0.00 0.00 0.010 A ATOM 4 C UNL d 1 9.593 -11.575 7.597 0.00 0.00 0.037 A ATOM 5 C UNL d 1 10.916 -11.327 7.945 0.00 0.00 0.065 A ATOM 6 C UNL d 1 11.853 -12.350 7.948 0.00 0.00 0.037 A ATOM 7 C UNL d 1 11.471 -13.643 7.585 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 11.340 -10.079 8.293 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 10.560 -9.519 8.448 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 9.598 -15.424 5.255 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 10.026 -14.386 4.411 0.00 0.00 0.010 A ATOM 12 C UNL d 1 9.806 -14.449 3.032 0.00 0.00 0.037 A ATOM 13 C UNL d 1 9.167 -15.559 2.491 0.00 0.00 0.065 A ATOM 14 C UNL d 1 8.773 -16.616 3.301 0.00 0.00 0.037 A ATOM 15 C UNL d 1 8.982 -16.547 4.681 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 8.908 -15.647 1.154 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 9.181 -14.814 0.735 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4