REMARK VINA RESULT: -5.3 2.621 4.092 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 12.185 4.616 -11.278 0.00 0.00 0.055 A ATOM 2 C UNL d 1 12.657 3.295 -11.285 0.00 0.00 0.055 A ATOM 3 C UNL d 1 10.814 4.872 -11.426 0.00 0.00 0.018 A ATOM 4 C UNL d 1 11.751 2.248 -11.510 0.00 0.00 0.018 A ATOM 5 C UNL d 1 9.920 3.820 -11.630 0.00 0.00 0.001 A ATOM 6 C UNL d 1 10.389 2.510 -11.687 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 14.082 2.932 -11.096 0.00 0.00 0.294 C ATOM 8 O UNL d 1 14.939 3.161 -11.936 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 14.250 2.276 -9.924 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 14.209 3.085 -8.738 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 12.861 2.896 -8.099 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 12.333 1.608 -7.942 0.00 0.00 0.009 A ATOM 13 C UNL d 1 11.002 1.435 -7.569 0.00 0.00 0.001 A ATOM 14 C UNL d 1 10.194 2.547 -7.339 0.00 0.00 0.000 A ATOM 15 C UNL d 1 10.728 3.831 -7.430 0.00 0.00 0.001 A ATOM 16 C UNL d 1 12.060 4.006 -7.802 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 13.079 5.797 -11.227 0.00 0.00 0.294 C ATOM 18 O UNL d 1 13.377 6.380 -10.203 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 13.347 6.166 -12.498 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 12.841 7.431 -12.949 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 12.098 7.192 -14.259 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 12.329 5.767 -14.767 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 11.038 4.984 -14.915 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9