REMARK VINA RESULT: -5.7 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 9.977 -15.430 6.432 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 9.626 -15.490 4.959 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 8.916 -16.581 4.433 0.00 0.00 0.010 A ATOM 4 C UNL d 1 8.639 -16.660 3.064 0.00 0.00 0.037 A ATOM 5 C UNL d 1 9.080 -15.649 2.217 0.00 0.00 0.065 A ATOM 6 C UNL d 1 9.773 -14.557 2.718 0.00 0.00 0.037 A ATOM 7 C UNL d 1 10.045 -14.473 4.086 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 8.852 -15.693 0.874 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 9.688 -15.515 0.412 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 9.918 -14.030 7.003 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 8.683 -13.432 7.302 0.00 0.00 0.010 A ATOM 12 C UNL d 1 8.618 -12.106 7.741 0.00 0.00 0.037 A ATOM 13 C UNL d 1 9.792 -11.377 7.894 0.00 0.00 0.065 A ATOM 14 C UNL d 1 11.027 -11.962 7.644 0.00 0.00 0.037 A ATOM 15 C UNL d 1 11.091 -13.283 7.194 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 9.770 -10.073 8.293 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 9.052 -9.963 8.937 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4