REMARK VINA RESULT: -6.8 1.880 5.894 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 -5.099 -2.338 5.513 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -6.093 -1.204 5.377 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -5.939 -0.227 4.381 0.00 0.00 0.010 A ATOM 4 C UNL d 1 -6.829 0.849 4.290 0.00 0.00 0.037 A ATOM 5 C UNL d 1 -7.873 0.952 5.203 0.00 0.00 0.065 A ATOM 6 C UNL d 1 -8.051 -0.009 6.188 0.00 0.00 0.037 A ATOM 7 C UNL d 1 -7.166 -1.087 6.275 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 -8.752 1.992 5.167 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 -9.126 2.113 6.056 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 -3.676 -1.925 5.206 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 -3.087 -0.840 5.875 0.00 0.00 0.010 A ATOM 12 C UNL d 1 -1.807 -0.397 5.529 0.00 0.00 0.037 A ATOM 13 C UNL d 1 -1.106 -1.046 4.520 0.00 0.00 0.065 A ATOM 14 C UNL d 1 -1.652 -2.148 3.873 0.00 0.00 0.037 A ATOM 15 C UNL d 1 -2.936 -2.583 4.211 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 0.133 -0.627 4.132 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 0.527 -1.317 3.575 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4