REMARK VINA RESULT: -5.2 2.082 5.309 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 33.754 7.541 29.751 0.00 0.00 0.055 A ATOM 2 C UNL d 1 32.859 6.470 29.895 0.00 0.00 0.055 A ATOM 3 C UNL d 1 33.267 8.848 29.605 0.00 0.00 0.018 A ATOM 4 C UNL d 1 31.481 6.718 29.822 0.00 0.00 0.018 A ATOM 5 C UNL d 1 31.892 9.084 29.552 0.00 0.00 0.001 A ATOM 6 C UNL d 1 30.999 8.019 29.646 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 33.288 5.064 30.094 0.00 0.00 0.294 C ATOM 8 O UNL d 1 33.071 4.185 29.274 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 33.868 4.916 31.308 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 32.973 4.872 32.431 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 32.978 6.230 33.076 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 31.787 6.958 33.188 0.00 0.00 0.009 A ATOM 13 C UNL d 1 31.816 8.298 33.568 0.00 0.00 0.001 A ATOM 14 C UNL d 1 33.033 8.915 33.849 0.00 0.00 0.000 A ATOM 15 C UNL d 1 34.217 8.182 33.802 0.00 0.00 0.001 A ATOM 16 C UNL d 1 34.190 6.840 33.424 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 35.221 7.362 29.635 0.00 0.00 0.294 C ATOM 18 O UNL d 1 35.766 6.803 28.703 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 35.780 7.779 30.792 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 37.186 7.561 30.973 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 37.545 8.011 32.385 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 37.725 6.809 33.315 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 37.606 7.182 34.781 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9