REMARK VINA RESULT: -6.8 0.000 0.000 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 30.269 76.319 104.534 0.00 0.00 0.055 A ATOM 2 C UNL d 1 30.357 74.920 104.463 0.00 0.00 0.055 A ATOM 3 C UNL d 1 29.014 76.940 104.617 0.00 0.00 0.018 A ATOM 4 C UNL d 1 29.177 74.165 104.406 0.00 0.00 0.018 A ATOM 5 C UNL d 1 27.847 76.175 104.579 0.00 0.00 0.001 A ATOM 6 C UNL d 1 27.927 74.789 104.458 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 31.641 74.181 104.413 0.00 0.00 0.294 C ATOM 8 O UNL d 1 32.049 73.632 103.400 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 32.220 74.160 105.636 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 33.636 73.918 105.657 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 34.276 75.008 106.471 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 33.625 75.514 107.603 0.00 0.00 0.009 A ATOM 13 C UNL d 1 34.093 76.671 108.224 0.00 0.00 0.001 A ATOM 14 C UNL d 1 35.220 77.320 107.725 0.00 0.00 0.000 A ATOM 15 C UNL d 1 35.912 76.788 106.638 0.00 0.00 0.001 A ATOM 16 C UNL d 1 35.447 75.630 106.017 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 31.446 77.213 104.419 0.00 0.00 0.294 C ATOM 18 O UNL d 1 32.150 77.532 105.357 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 31.473 77.699 103.160 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 32.289 77.018 102.196 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 33.637 76.736 102.850 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 34.714 77.682 102.314 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 35.444 78.422 103.420 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9