REMARK VINA RESULT: -4.9 1.950 5.007 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 12.159 3.982 -12.326 0.00 0.00 0.055 C ATOM 2 C UNL d 1 12.276 4.919 -13.361 0.00 0.00 0.055 C ATOM 3 C UNL d 1 13.292 3.652 -11.561 0.00 0.00 0.018 C ATOM 4 C UNL d 1 13.550 5.368 -13.739 0.00 0.00 0.018 C ATOM 5 C UNL d 1 14.548 4.153 -11.904 0.00 0.00 0.001 C ATOM 6 C UNL d 1 14.684 4.970 -13.023 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 10.956 3.143 -12.092 0.00 0.00 0.294 C ATOM 8 O UNL d 1 10.624 2.248 -12.850 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 10.200 3.699 -11.115 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 9.900 2.909 -9.945 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 11.073 2.746 -8.983 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 11.453 4.021 -8.234 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 12.931 4.115 -7.861 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 11.114 5.469 -14.085 0.00 0.00 0.294 C ATOM 15 O UNL d 1 10.473 4.844 -14.912 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 10.959 6.781 -13.766 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 10.173 7.075 -12.597 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 10.950 7.892 -11.563 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 11.438 7.057 -10.380 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 12.953 7.119 -10.233 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10