REMARK VINA RESULT: -7.8 1.238 3.545 REMARK 9 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_7 REMARK 2 A between atoms: O_1 and C_11 REMARK 3 A between atoms: O_2 and C_13 REMARK 4 A between atoms: O_2 and C_16 REMARK 5 A between atoms: C_5 and C_6 REMARK 6 A between atoms: C_5 and C_7 REMARK 7 A between atoms: C_8 and C_11 REMARK 8 A between atoms: C_9 and C_16 REMARK 9 A between atoms: C_13 and C_14 ROOT ATOM 1 C UNL d 1 7.926 2.674 3.756 0.00 0.00 0.055 A ATOM 2 C UNL d 1 7.113 3.692 3.234 0.00 0.00 0.055 A ATOM 3 C UNL d 1 8.926 2.097 2.959 0.00 0.00 0.018 A ATOM 4 C UNL d 1 7.271 4.070 1.893 0.00 0.00 0.018 A ATOM 5 C UNL d 1 9.085 2.496 1.631 0.00 0.00 0.001 A ATOM 6 C UNL d 1 8.249 3.471 1.093 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 6.061 4.383 4.017 0.00 0.00 0.294 C ATOM 8 O UNL d 1 6.268 4.866 5.120 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 4.876 4.327 3.365 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 4.246 5.590 3.096 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 2.992 5.663 3.923 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 1.739 5.687 3.298 0.00 0.00 0.009 A ATOM 13 C UNL d 1 0.594 5.986 4.033 0.00 0.00 0.001 A ATOM 14 C UNL d 1 0.692 6.251 5.398 0.00 0.00 0.000 A ATOM 15 C UNL d 1 1.926 6.167 6.040 0.00 0.00 0.001 A ATOM 16 C UNL d 1 3.073 5.866 5.307 0.00 0.00 0.009 A ENDBRANCH 10 11 ENDBRANCH 9 10 ENDBRANCH 7 9 ENDBRANCH 2 7 BRANCH 1 17 ATOM 17 C UNL d 1 7.721 2.081 5.099 0.00 0.00 0.294 C ATOM 18 O UNL d 1 8.531 2.149 6.003 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 6.585 1.351 5.058 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 5.695 1.436 6.179 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 4.314 1.806 5.645 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 4.062 1.158 4.282 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 2.869 1.759 3.562 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9