REMARK VINA RESULT: -4.5 1.688 6.015 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 20.211 -31.492 -2.321 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 18.923 -30.771 -2.660 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 18.299 -29.934 -1.722 0.00 0.00 0.010 A ATOM 4 C UNL d 1 17.082 -29.310 -2.018 0.00 0.00 0.037 A ATOM 5 C UNL d 1 16.483 -29.531 -3.253 0.00 0.00 0.065 A ATOM 6 C UNL d 1 17.088 -30.346 -4.199 0.00 0.00 0.037 A ATOM 7 C UNL d 1 18.307 -30.963 -3.907 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 15.288 -28.962 -3.578 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 15.112 -29.129 -4.520 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 20.558 -31.438 -0.850 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 19.936 -32.304 0.064 0.00 0.00 0.010 A ATOM 12 C UNL d 1 20.183 -32.194 1.435 0.00 0.00 0.037 A ATOM 13 C UNL d 1 21.064 -31.224 1.897 0.00 0.00 0.065 A ATOM 14 C UNL d 1 21.723 -30.383 1.008 0.00 0.00 0.037 A ATOM 15 C UNL d 1 21.467 -30.485 -0.361 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 21.311 -31.065 3.230 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 22.156 -31.496 3.436 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4