REMARK VINA RESULT: -8.0 1.187 5.966 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 -0.870 -4.921 4.759 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -1.747 -4.333 5.846 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -1.547 -3.021 6.301 0.00 0.00 0.010 A ATOM 4 C UNL d 1 -2.323 -2.498 7.341 0.00 0.00 0.037 A ATOM 5 C UNL d 1 -3.297 -3.294 7.934 0.00 0.00 0.065 A ATOM 6 C UNL d 1 -3.519 -4.590 7.493 0.00 0.00 0.037 A ATOM 7 C UNL d 1 -2.750 -5.111 6.449 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 -4.063 -2.836 8.964 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 -4.093 -1.865 8.919 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 0.252 -5.782 5.296 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 1.554 -5.657 4.787 0.00 0.00 0.010 A ATOM 12 C UNL d 1 2.573 -6.514 5.212 0.00 0.00 0.037 A ATOM 13 C UNL d 1 2.295 -7.493 6.159 0.00 0.00 0.065 A ATOM 14 C UNL d 1 1.023 -7.608 6.708 0.00 0.00 0.037 A ATOM 15 C UNL d 1 0.002 -6.759 6.273 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 3.253 -8.368 6.580 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 3.086 -8.577 7.514 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4