REMARK VINA RESULT: -7.4 0.096 5.955 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 -3.843 -0.221 3.667 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -5.205 0.328 4.039 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -5.789 1.368 3.300 0.00 0.00 0.010 A ATOM 4 C UNL d 1 -7.023 1.908 3.677 0.00 0.00 0.037 A ATOM 5 C UNL d 1 -7.672 1.411 4.801 0.00 0.00 0.065 A ATOM 6 C UNL d 1 -7.119 0.376 5.540 0.00 0.00 0.037 A ATOM 7 C UNL d 1 -5.890 -0.169 5.160 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 -8.866 1.920 5.219 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 -9.261 1.300 5.855 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 -3.427 -1.408 4.507 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 -2.428 -1.276 5.485 0.00 0.00 0.010 A ATOM 12 C UNL d 1 -1.974 -2.390 6.198 0.00 0.00 0.037 A ATOM 13 C UNL d 1 -2.528 -3.639 5.943 0.00 0.00 0.065 A ATOM 14 C UNL d 1 -3.547 -3.786 5.010 0.00 0.00 0.037 A ATOM 15 C UNL d 1 -3.991 -2.675 4.289 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 -2.093 -4.755 6.596 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 -2.614 -5.513 6.283 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4