REMARK VINA RESULT: -7.1 0.977 3.767 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 -6.341 -1.683 3.669 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -5.363 -2.130 4.571 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -7.698 -1.927 3.926 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -5.759 -2.878 5.690 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -8.080 -2.656 5.053 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -7.112 -3.145 5.927 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -3.912 -1.882 4.397 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -3.219 -1.377 5.268 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -3.522 -2.228 3.148 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -2.150 -1.956 2.820 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -2.076 -1.690 1.342 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -2.806 -2.484 0.449 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -2.569 -2.399 -0.922 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -1.609 -1.513 -1.408 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -0.924 -0.674 -0.532 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -1.161 -0.756 0.839 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 -6.015 -1.044 2.372 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -5.859 0.153 2.225 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -6.086 -1.993 1.414 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -6.461 -1.583 0.092 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -6.713 -2.844 -0.729 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -5.798 -3.984 -0.275 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -5.408 -4.908 -1.415 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9