REMARK VINA RESULT: -4.9 2.880 7.625 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 43.816 67.143 54.686 0.00 0.00 0.055 A ATOM 2 C UNL d 1 42.817 67.334 55.653 0.00 0.00 0.055 A ATOM 3 C UNL d 1 44.341 68.243 53.992 0.00 0.00 0.018 A ATOM 4 C UNL d 1 42.309 68.625 55.861 0.00 0.00 0.018 A ATOM 5 C UNL d 1 43.839 69.525 54.222 0.00 0.00 0.001 A ATOM 6 C UNL d 1 42.814 69.715 55.145 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 42.236 66.235 56.460 0.00 0.00 0.294 C ATOM 8 O UNL d 1 41.196 65.670 56.155 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 42.978 66.023 57.571 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 43.420 64.673 57.786 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 42.676 64.130 58.974 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 43.224 64.245 60.258 0.00 0.00 0.009 A ATOM 13 C UNL d 1 42.663 63.549 61.326 0.00 0.00 0.001 A ATOM 14 C UNL d 1 41.544 62.744 61.121 0.00 0.00 0.000 A ATOM 15 C UNL d 1 40.953 62.675 59.860 0.00 0.00 0.001 A ATOM 16 C UNL d 1 41.512 63.372 58.790 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 44.292 65.803 54.266 0.00 0.00 0.294 C ATOM 18 O UNL d 1 43.680 65.071 53.512 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 45.401 65.516 54.981 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 45.843 64.152 55.012 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 47.151 64.107 55.796 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 48.353 64.284 54.865 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 48.820 62.973 54.260 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9