REMARK VINA RESULT: -5.1 1.794 4.704 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 32.744 6.150 32.554 0.00 0.00 0.055 C ATOM 2 C UNL d 1 33.588 5.378 31.743 0.00 0.00 0.055 C ATOM 3 C UNL d 1 32.454 5.715 33.860 0.00 0.00 0.018 C ATOM 4 C UNL d 1 33.973 4.101 32.176 0.00 0.00 0.018 C ATOM 5 C UNL d 1 32.894 4.469 34.306 0.00 0.00 0.001 C ATOM 6 C UNL d 1 33.611 3.642 33.446 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 31.956 7.312 32.071 0.00 0.00 0.294 C ATOM 8 O UNL d 1 32.054 8.421 32.567 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 30.979 6.880 31.236 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 30.308 7.851 30.405 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 30.704 7.794 28.933 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 32.023 8.492 28.610 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 32.208 9.839 29.305 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 34.102 5.845 30.442 0.00 0.00 0.294 C ATOM 15 O UNL d 1 33.588 5.569 29.372 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 35.270 6.514 30.628 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 35.187 7.948 30.725 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 35.682 8.471 32.073 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 36.532 7.457 32.838 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 35.899 7.084 34.173 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10