REMARK VINA RESULT: -5.4 1.676 3.662 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 10.933 4.737 -12.482 0.00 0.00 0.055 A ATOM 2 C UNL d 1 12.259 5.142 -12.269 0.00 0.00 0.055 A ATOM 3 C UNL d 1 9.966 5.676 -12.871 0.00 0.00 0.018 A ATOM 4 C UNL d 1 12.583 6.502 -12.381 0.00 0.00 0.018 A ATOM 5 C UNL d 1 10.306 7.024 -12.998 0.00 0.00 0.001 A ATOM 6 C UNL d 1 11.609 7.440 -12.739 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 13.351 4.211 -11.896 0.00 0.00 0.294 C ATOM 8 O UNL d 1 14.050 3.647 -12.724 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 13.392 4.047 -10.553 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 14.564 3.400 -10.034 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 14.112 2.250 -9.176 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 14.567 2.138 -7.856 0.00 0.00 0.009 A ATOM 13 C UNL d 1 14.344 0.968 -7.134 0.00 0.00 0.001 A ATOM 14 C UNL d 1 13.656 -0.092 -7.721 0.00 0.00 0.000 A ATOM 15 C UNL d 1 13.144 0.035 -9.012 0.00 0.00 0.001 A ATOM 16 C UNL d 1 13.364 1.206 -9.735 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 10.452 3.360 -12.216 0.00 0.00 0.294 C ATOM 18 O UNL d 1 10.626 2.422 -12.969 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 9.685 3.399 -11.105 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 10.183 2.753 -9.925 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 10.766 3.833 -9.018 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 10.869 3.337 -7.574 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 10.421 1.895 -7.418 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9