REMARK VINA RESULT: -5.2 2.198 4.871 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 0.303 -0.086 10.731 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -0.197 -0.592 9.520 0.00 0.00 0.055 A ATOM 3 C UNL d 1 0.081 -0.782 11.928 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -0.974 -1.759 9.539 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -0.679 -1.953 11.929 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -1.219 -2.434 10.739 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 0.025 0.058 8.207 0.00 0.00 0.294 C ATOM 8 O UNL d 1 1.140 0.272 7.755 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -1.157 0.418 7.654 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -1.850 1.497 8.300 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -3.028 0.914 9.030 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -3.208 1.175 10.394 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -4.153 0.461 11.127 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -4.933 -0.508 10.499 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -4.806 -0.729 9.129 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -3.862 -0.015 8.394 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 0.980 1.228 10.842 0.00 0.00 0.294 C ATOM 18 O UNL d 1 2.178 1.389 10.707 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 0.065 2.129 11.262 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 0.391 2.930 12.406 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 0.776 4.318 11.904 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 1.049 5.267 13.074 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 0.206 4.946 14.294 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9