REMARK VINA RESULT: -4.5 1.069 1.421 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 -4.107 -16.486 4.917 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -3.052 -15.907 4.196 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -5.303 -16.821 4.265 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -3.239 -15.607 2.838 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -5.469 -16.534 2.909 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -4.444 -15.915 2.199 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -1.742 -15.559 4.796 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -1.564 -14.543 5.449 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -0.809 -16.478 4.454 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -0.594 -17.538 5.399 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -0.435 -18.818 4.626 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -0.369 -18.789 3.227 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -0.455 -19.972 2.496 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -0.594 -21.190 3.158 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -0.596 -21.234 4.551 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -0.508 -20.052 5.284 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 -4.076 -16.677 6.387 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -3.954 -17.758 6.929 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -4.359 -15.488 6.963 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -5.671 -15.307 7.513 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -6.040 -13.835 7.353 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -5.520 -13.283 6.024 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -4.453 -12.220 6.212 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9