REMARK VINA RESULT: 0.2 1.251 2.190 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 4.395 -3.158 10.696 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 4.411 -3.982 11.967 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 4.044 -5.336 11.951 0.00 0.00 0.010 A ATOM 4 C UNL d 1 4.010 -6.082 13.135 0.00 0.00 0.037 A ATOM 5 C UNL d 1 4.336 -5.468 14.339 0.00 0.00 0.065 A ATOM 6 C UNL d 1 4.712 -4.133 14.376 0.00 0.00 0.037 A ATOM 7 C UNL d 1 4.754 -3.390 13.194 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 4.296 -6.148 15.520 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 4.144 -7.089 15.330 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 5.188 -3.783 9.568 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 4.702 -3.752 8.251 0.00 0.00 0.010 A ATOM 12 C UNL d 1 5.383 -4.409 7.223 0.00 0.00 0.037 A ATOM 13 C UNL d 1 6.562 -5.089 7.506 0.00 0.00 0.065 A ATOM 14 C UNL d 1 7.083 -5.097 8.794 0.00 0.00 0.037 A ATOM 15 C UNL d 1 6.395 -4.451 9.824 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 7.242 -5.766 6.537 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 6.903 -6.676 6.507 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4