REMARK VINA RESULT: -6.5 1.474 4.392 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 32.896 77.694 101.938 0.00 0.00 0.055 A ATOM 2 C UNL d 1 33.269 76.881 103.019 0.00 0.00 0.055 A ATOM 3 C UNL d 1 33.790 78.652 101.438 0.00 0.00 0.018 A ATOM 4 C UNL d 1 34.514 77.089 103.630 0.00 0.00 0.018 A ATOM 5 C UNL d 1 35.034 78.837 102.044 0.00 0.00 0.001 A ATOM 6 C UNL d 1 35.391 78.067 103.148 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 32.404 75.818 103.583 0.00 0.00 0.294 C ATOM 8 O UNL d 1 32.354 74.690 103.118 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 31.663 76.307 104.605 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 31.588 75.482 105.779 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 32.904 75.589 106.500 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 33.267 76.789 107.123 0.00 0.00 0.009 A ATOM 13 C UNL d 1 34.567 76.972 107.590 0.00 0.00 0.001 A ATOM 14 C UNL d 1 35.508 75.954 107.446 0.00 0.00 0.000 A ATOM 15 C UNL d 1 35.138 74.733 106.885 0.00 0.00 0.001 A ATOM 16 C UNL d 1 33.837 74.547 106.420 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 31.540 77.675 101.339 0.00 0.00 0.294 C ATOM 18 O UNL d 1 31.236 77.013 100.366 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 30.800 78.616 101.965 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 29.440 78.294 102.286 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 29.209 78.664 103.748 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 28.371 77.597 104.457 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 28.264 76.312 103.657 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9