REMARK VINA RESULT: -4.6 1.740 4.438 REMARK 10 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_9 REMARK 2 A between atoms: O_1 and C_15 REMARK 3 A between atoms: O_2 and C_10 REMARK 4 A between atoms: O_2 and C_16 REMARK 5 A between atoms: C_5 and C_7 REMARK 6 A between atoms: C_5 and C_9 REMARK 7 A between atoms: C_6 and C_8 REMARK 8 A between atoms: C_6 and C_10 REMARK 9 A between atoms: C_11 and C_15 REMARK 10 A between atoms: C_12 and C_16 ROOT ATOM 1 C UNL d 1 14.039 44.303 26.258 0.00 0.00 0.055 C ATOM 2 C UNL d 1 14.609 43.348 27.111 0.00 0.00 0.055 C ATOM 3 C UNL d 1 14.863 45.273 25.658 0.00 0.00 0.018 C ATOM 4 C UNL d 1 15.948 43.490 27.501 0.00 0.00 0.018 C ATOM 5 C UNL d 1 16.211 45.369 26.004 0.00 0.00 0.001 C ATOM 6 C UNL d 1 16.740 44.509 26.963 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 12.578 44.502 26.084 0.00 0.00 0.294 C ATOM 8 O UNL d 1 11.929 43.896 25.248 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 12.186 45.600 26.775 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 11.551 45.414 28.057 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 12.496 45.549 29.248 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 11.849 45.260 30.600 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 12.736 45.575 31.802 0.00 0.00 0.005 C ENDBRANCH 11 12 ENDBRANCH 10 11 ENDBRANCH 9 10 ENDBRANCH 7 9 ENDBRANCH 1 7 BRANCH 2 14 ATOM 14 C UNL d 1 13.864 42.184 27.627 0.00 0.00 0.294 C ATOM 15 O UNL d 1 13.109 42.232 28.582 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 14.242 41.067 26.951 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 13.274 40.496 26.051 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 13.555 40.851 24.591 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 15.016 41.211 24.328 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 15.147 42.312 23.283 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10