REMARK VINA RESULT: -5.9 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 -3.993 12.895 -13.841 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -4.341 13.638 -15.115 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -5.032 14.858 -15.070 0.00 0.00 0.010 A ATOM 4 C UNL d 1 -5.398 15.517 -16.249 0.00 0.00 0.037 A ATOM 5 C UNL d 1 -5.078 14.948 -17.477 0.00 0.00 0.065 A ATOM 6 C UNL d 1 -4.386 13.748 -17.545 0.00 0.00 0.037 A ATOM 7 C UNL d 1 -4.013 13.094 -16.367 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 -5.432 15.542 -18.652 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 -6.379 15.760 -18.616 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 -2.684 12.141 -13.927 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 -2.632 10.867 -14.514 0.00 0.00 0.010 A ATOM 12 C UNL d 1 -1.445 10.127 -14.512 0.00 0.00 0.037 A ATOM 13 C UNL d 1 -0.303 10.666 -13.932 0.00 0.00 0.065 A ATOM 14 C UNL d 1 -0.321 11.943 -13.383 0.00 0.00 0.037 A ATOM 15 C UNL d 1 -1.510 12.676 -13.375 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 0.867 9.966 -13.884 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 0.757 9.233 -13.256 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4