REMARK VINA RESULT: -6.2 1.778 4.023 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 -5.738 -3.191 -0.817 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -6.022 -2.792 0.498 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -5.829 -4.544 -1.175 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -6.328 -3.770 1.456 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -6.153 -5.505 -0.216 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -6.388 -5.121 1.101 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -5.989 -1.381 0.952 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -6.955 -0.638 0.868 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -4.750 -1.055 1.386 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -4.675 -0.473 2.697 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -3.871 -1.399 3.566 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -2.473 -1.303 3.590 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -1.712 -2.295 4.204 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -2.342 -3.382 4.807 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -3.733 -3.453 4.844 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -4.497 -2.461 4.232 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 -5.232 -2.262 -1.855 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -5.901 -1.382 -2.363 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -3.999 -2.677 -2.215 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -2.885 -2.219 -1.436 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -2.206 -3.446 -0.835 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -2.298 -3.429 0.693 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -2.693 -4.776 1.268 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9