REMARK VINA RESULT: -7.1 1.588 5.381 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 -5.675 -1.525 0.691 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -5.410 -1.214 2.033 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -6.410 -0.634 -0.105 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -5.948 -0.039 2.579 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -6.923 0.541 0.446 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -6.706 0.832 1.790 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -4.610 -2.078 2.933 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -3.389 -2.115 2.900 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -5.423 -2.833 3.708 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -5.388 -2.553 5.116 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -6.799 -2.619 5.633 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -7.042 -2.958 6.970 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -8.336 -3.247 7.397 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -9.396 -3.187 6.495 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -9.173 -2.787 5.178 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -7.879 -2.496 4.749 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 -5.306 -2.820 0.071 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -5.620 -3.904 0.524 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -4.461 -2.563 -0.950 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -3.556 -3.602 -1.348 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -2.224 -3.348 -0.648 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -1.666 -1.972 -1.017 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -1.264 -1.160 0.200 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9