REMARK VINA RESULT: -7.3 1.848 5.949 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 -5.312 -1.223 1.935 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -5.258 -1.738 3.359 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -6.435 -2.042 4.059 0.00 0.00 0.010 A ATOM 4 C UNL d 1 -6.385 -2.468 5.392 0.00 0.00 0.037 A ATOM 5 C UNL d 1 -5.154 -2.582 6.027 0.00 0.00 0.065 A ATOM 6 C UNL d 1 -3.977 -2.297 5.350 0.00 0.00 0.037 A ATOM 7 C UNL d 1 -4.025 -1.879 4.018 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 -5.057 -2.972 7.329 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 -4.119 -3.119 7.539 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 -4.840 -2.235 0.915 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 -5.678 -3.287 0.512 0.00 0.00 0.010 A ATOM 12 C UNL d 1 -5.214 -4.278 -0.358 0.00 0.00 0.037 A ATOM 13 C UNL d 1 -3.912 -4.212 -0.839 0.00 0.00 0.065 A ATOM 14 C UNL d 1 -3.078 -3.157 -0.487 0.00 0.00 0.037 A ATOM 15 C UNL d 1 -3.539 -2.174 0.392 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 -3.411 -5.174 -1.667 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 -2.836 -4.743 -2.322 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4