REMARK VINA RESULT: -5.5 1.874 5.312 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 -0.947 13.807 -14.475 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -2.111 14.582 -14.351 0.00 0.00 0.055 A ATOM 3 C UNL d 1 0.076 14.211 -15.345 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -2.260 15.720 -15.157 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -0.077 15.357 -16.127 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -1.250 16.103 -16.045 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -3.222 14.250 -13.428 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -3.269 14.655 -12.277 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -4.096 13.407 -14.027 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -5.465 13.841 -14.064 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -5.763 14.298 -15.465 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -5.792 13.371 -16.515 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -5.837 13.809 -17.837 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -5.866 15.173 -18.117 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -5.902 16.101 -17.078 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -5.859 15.666 -15.754 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 -0.771 12.496 -13.805 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -0.580 12.364 -12.612 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -0.706 11.548 -14.765 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -1.936 11.114 -15.362 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -2.399 9.868 -14.614 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -2.034 8.599 -15.388 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -2.179 7.342 -14.550 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9