REMARK VINA RESULT: -4.6 1.686 5.144 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 32.865 7.389 29.403 0.00 0.00 0.055 A ATOM 2 C UNL d 1 32.457 8.656 29.850 0.00 0.00 0.055 A ATOM 3 C UNL d 1 31.949 6.542 28.762 0.00 0.00 0.018 A ATOM 4 C UNL d 1 31.112 9.027 29.708 0.00 0.00 0.018 A ATOM 5 C UNL d 1 30.618 6.932 28.610 0.00 0.00 0.001 A ATOM 6 C UNL d 1 30.195 8.167 29.095 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 33.366 9.628 30.500 0.00 0.00 0.294 C ATOM 8 O UNL d 1 33.529 10.764 30.080 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 34.006 9.050 31.544 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 33.271 8.989 32.776 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 33.340 7.575 33.283 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 34.570 7.028 33.670 0.00 0.00 0.009 A ATOM 13 C UNL d 1 34.684 5.662 33.918 0.00 0.00 0.001 A ATOM 14 C UNL d 1 33.568 4.837 33.793 0.00 0.00 0.000 A ATOM 15 C UNL d 1 32.326 5.383 33.471 0.00 0.00 0.001 A ATOM 16 C UNL d 1 32.210 6.750 33.224 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 34.214 6.833 29.666 0.00 0.00 0.294 C ATOM 18 O UNL d 1 34.441 5.958 30.479 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 35.106 7.572 28.972 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 36.387 6.988 28.695 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 37.435 7.783 29.468 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 37.645 7.197 30.866 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 37.562 8.249 31.957 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9