REMARK VINA RESULT: -6.5 0.812 1.553 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 -8.556 -3.943 1.665 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -7.580 -3.996 2.822 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -7.284 -2.844 3.567 0.00 0.00 0.010 A ATOM 4 C UNL d 1 -6.344 -2.884 4.603 0.00 0.00 0.037 A ATOM 5 C UNL d 1 -5.692 -4.078 4.889 0.00 0.00 0.065 A ATOM 6 C UNL d 1 -5.976 -5.231 4.172 0.00 0.00 0.037 A ATOM 7 C UNL d 1 -6.921 -5.194 3.143 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 -4.753 -4.160 5.874 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 -4.033 -3.541 5.667 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 -8.114 -3.016 0.553 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 -8.682 -1.739 0.421 0.00 0.00 0.010 A ATOM 12 C UNL d 1 -8.347 -0.916 -0.658 0.00 0.00 0.037 A ATOM 13 C UNL d 1 -7.432 -1.364 -1.603 0.00 0.00 0.065 A ATOM 14 C UNL d 1 -6.826 -2.607 -1.470 0.00 0.00 0.037 A ATOM 15 C UNL d 1 -7.170 -3.435 -0.398 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 -7.099 -0.604 -2.686 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 -7.919 -0.299 -3.108 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4