REMARK VINA RESULT: -4.1 2.174 3.888 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 -2.897 -13.755 5.593 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -1.931 -14.719 5.919 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -2.504 -12.518 5.061 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -0.573 -14.400 5.772 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -1.149 -12.221 4.902 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -0.184 -13.154 5.270 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -2.261 -16.064 6.448 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -2.731 -16.240 7.561 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -1.904 -17.020 5.558 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -1.408 -18.247 6.117 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -0.836 -19.065 4.994 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -0.441 -18.444 3.802 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -0.130 -19.209 2.680 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -0.200 -20.599 2.745 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -0.530 -21.228 3.945 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -0.840 -20.464 5.069 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 -4.342 -13.926 5.879 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -4.844 -13.749 6.972 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -4.921 -14.447 4.776 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -5.560 -15.726 4.896 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -5.124 -16.574 3.705 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -4.261 -15.759 2.740 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -2.941 -16.438 2.423 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9