REMARK VINA RESULT: -7.4 0.000 0.000 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 -3.809 -0.190 3.743 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -3.365 -1.375 4.576 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -2.361 -1.236 5.546 0.00 0.00 0.010 A ATOM 4 C UNL d 1 -1.916 -2.343 6.278 0.00 0.00 0.037 A ATOM 5 C UNL d 1 -2.471 -3.593 6.033 0.00 0.00 0.065 A ATOM 6 C UNL d 1 -3.473 -3.751 5.085 0.00 0.00 0.037 A ATOM 7 C UNL d 1 -3.923 -2.645 4.360 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 -2.055 -4.703 6.705 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 -2.043 -4.502 7.656 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 -5.191 0.309 4.102 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 -5.816 1.302 3.330 0.00 0.00 0.010 A ATOM 12 C UNL d 1 -7.051 1.833 3.711 0.00 0.00 0.037 A ATOM 13 C UNL d 1 -7.673 1.362 4.862 0.00 0.00 0.065 A ATOM 14 C UNL d 1 -7.094 0.351 5.618 0.00 0.00 0.037 A ATOM 15 C UNL d 1 -5.853 -0.171 5.244 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 -8.866 1.873 5.285 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 -8.689 2.512 5.995 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4