REMARK VINA RESULT: -1.3 1.595 4.327 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 8.221 -4.741 9.561 0.00 0.00 0.055 A ATOM 2 C UNL d 1 7.603 -3.863 10.465 0.00 0.00 0.055 A ATOM 3 C UNL d 1 9.616 -4.882 9.562 0.00 0.00 0.018 A ATOM 4 C UNL d 1 8.403 -3.084 11.313 0.00 0.00 0.018 A ATOM 5 C UNL d 1 10.400 -4.113 10.424 0.00 0.00 0.001 A ATOM 6 C UNL d 1 9.796 -3.204 11.289 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 6.135 -3.683 10.560 0.00 0.00 0.294 C ATOM 8 O UNL d 1 5.558 -2.707 10.105 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 5.580 -4.700 11.261 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 4.245 -4.477 11.742 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 4.233 -4.773 13.216 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 4.524 -3.760 14.139 0.00 0.00 0.009 A ATOM 13 C UNL d 1 4.742 -4.072 15.479 0.00 0.00 0.001 A ATOM 14 C UNL d 1 4.659 -5.396 15.907 0.00 0.00 0.000 A ATOM 15 C UNL d 1 4.308 -6.402 15.009 0.00 0.00 0.001 A ATOM 16 C UNL d 1 4.087 -6.091 13.668 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 7.480 -5.473 8.506 0.00 0.00 0.294 C ATOM 18 O UNL d 1 7.754 -6.600 8.140 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 6.593 -4.616 7.956 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 6.334 -4.733 6.550 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 4.884 -4.323 6.312 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 4.406 -3.349 7.391 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 3.173 -3.847 8.122 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9