REMARK VINA RESULT: -8.2 1.249 6.100 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 -1.050 -4.836 4.822 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -1.878 -4.295 5.969 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -2.905 -5.063 6.539 0.00 0.00 0.010 A ATOM 4 C UNL d 1 -3.704 -4.543 7.564 0.00 0.00 0.037 A ATOM 5 C UNL d 1 -3.478 -3.247 8.014 0.00 0.00 0.065 A ATOM 6 C UNL d 1 -2.462 -2.474 7.473 0.00 0.00 0.037 A ATOM 7 C UNL d 1 -1.659 -2.996 6.455 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 -4.243 -2.690 8.995 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 -4.070 -3.160 9.828 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 0.116 -5.687 5.275 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 1.395 -5.496 4.728 0.00 0.00 0.010 A ATOM 12 C UNL d 1 2.454 -6.341 5.074 0.00 0.00 0.037 A ATOM 13 C UNL d 1 2.239 -7.373 5.980 0.00 0.00 0.065 A ATOM 14 C UNL d 1 0.992 -7.554 6.566 0.00 0.00 0.037 A ATOM 15 C UNL d 1 -0.069 -6.718 6.210 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 3.238 -8.237 6.322 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 2.945 -8.751 7.092 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4