REMARK VINA RESULT: -4.2 2.375 6.895 REMARK 10 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_9 REMARK 2 A between atoms: O_1 and C_15 REMARK 3 A between atoms: O_2 and C_10 REMARK 4 A between atoms: O_2 and C_16 REMARK 5 A between atoms: C_5 and C_7 REMARK 6 A between atoms: C_5 and C_9 REMARK 7 A between atoms: C_6 and C_8 REMARK 8 A between atoms: C_6 and C_10 REMARK 9 A between atoms: C_11 and C_15 REMARK 10 A between atoms: C_12 and C_16 ROOT ATOM 1 C UNL d 1 42.858 65.514 56.462 0.00 0.00 0.055 C ATOM 2 C UNL d 1 43.778 65.751 55.432 0.00 0.00 0.055 C ATOM 3 C UNL d 1 41.790 66.410 56.654 0.00 0.00 0.018 C ATOM 4 C UNL d 1 43.730 66.968 54.737 0.00 0.00 0.018 C ATOM 5 C UNL d 1 41.714 67.590 55.915 0.00 0.00 0.001 C ATOM 6 C UNL d 1 42.712 67.892 54.992 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 43.031 64.481 57.515 0.00 0.00 0.294 C ATOM 8 O UNL d 1 42.459 63.405 57.478 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 43.665 65.026 58.583 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 44.760 64.296 59.176 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 44.355 63.409 60.350 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 43.218 63.972 61.200 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 41.938 63.140 61.168 0.00 0.00 0.005 C ENDBRANCH 11 12 ENDBRANCH 10 11 ENDBRANCH 9 10 ENDBRANCH 7 9 ENDBRANCH 1 7 BRANCH 2 14 ATOM 14 C UNL d 1 44.808 64.773 55.032 0.00 0.00 0.294 C ATOM 15 O UNL d 1 44.593 63.824 54.299 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 45.966 65.038 55.693 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 46.918 63.963 55.786 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 48.243 64.296 55.099 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 48.827 63.122 54.313 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 47.750 62.122 53.910 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10