REMARK VINA RESULT: -4.8 1.813 4.828 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 -3.162 12.288 -14.886 0.00 0.00 0.055 C ATOM 2 C UNL d 1 -2.723 13.002 -13.763 0.00 0.00 0.055 C ATOM 3 C UNL d 1 -2.529 11.079 -15.227 0.00 0.00 0.018 C ATOM 4 C UNL d 1 -1.545 12.602 -13.114 0.00 0.00 0.018 C ATOM 5 C UNL d 1 -1.394 10.654 -14.536 0.00 0.00 0.001 C ATOM 6 C UNL d 1 -0.874 11.442 -13.513 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 -4.132 12.811 -15.881 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -5.331 12.604 -15.799 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -3.462 13.277 -16.963 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 -4.205 13.990 -17.975 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 -4.412 15.471 -17.671 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 -5.838 15.836 -17.267 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 -6.029 16.060 -15.769 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 -3.444 14.168 -13.218 0.00 0.00 0.294 C ATOM 15 O UNL d 1 -4.605 14.134 -12.850 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 -2.655 15.271 -13.304 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 -2.538 15.883 -14.602 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 -1.082 16.085 -15.022 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 -0.558 14.976 -15.933 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 0.714 14.347 -15.380 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10