REMARK VINA RESULT: -5.2 1.045 1.758 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 9.164 -6.875 -6.443 0.00 0.00 0.055 A ATOM 2 C UNL d 1 8.822 -7.981 -5.650 0.00 0.00 0.055 A ATOM 3 C UNL d 1 9.344 -7.031 -7.825 0.00 0.00 0.018 A ATOM 4 C UNL d 1 8.733 -9.247 -6.247 0.00 0.00 0.018 A ATOM 5 C UNL d 1 9.233 -8.293 -8.411 0.00 0.00 0.001 A ATOM 6 C UNL d 1 8.943 -9.403 -7.621 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 8.575 -7.898 -4.190 0.00 0.00 0.294 C ATOM 8 O UNL d 1 9.446 -7.595 -3.389 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 7.304 -8.265 -3.906 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 6.322 -7.218 -3.950 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 5.585 -7.224 -2.640 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 4.329 -7.837 -2.544 0.00 0.00 0.009 A ATOM 13 C UNL d 1 3.541 -7.650 -1.410 0.00 0.00 0.001 A ATOM 14 C UNL d 1 4.009 -6.860 -0.361 0.00 0.00 0.000 A ATOM 15 C UNL d 1 5.283 -6.300 -0.421 0.00 0.00 0.001 A ATOM 16 C UNL d 1 6.074 -6.487 -1.553 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 9.458 -5.534 -5.882 0.00 0.00 0.294 C ATOM 18 O UNL d 1 10.130 -5.347 -4.887 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 8.729 -4.630 -6.572 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 9.361 -3.392 -6.927 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 10.527 -3.718 -7.855 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 11.730 -2.820 -7.557 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 12.039 -2.731 -6.074 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9