REMARK VINA RESULT: -7.2 0.116 5.749 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 4.870 2.643 3.519 0.00 0.00 0.055 C ATOM 2 C UNL d 1 4.471 3.987 3.504 0.00 0.00 0.055 C ATOM 3 C UNL d 1 5.949 2.234 2.714 0.00 0.00 0.018 C ATOM 4 C UNL d 1 5.024 4.855 2.552 0.00 0.00 0.018 C ATOM 5 C UNL d 1 6.537 3.122 1.813 0.00 0.00 0.001 C ATOM 6 C UNL d 1 6.041 4.418 1.697 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 4.108 1.553 4.179 0.00 0.00 0.294 C ATOM 8 O UNL d 1 2.910 1.398 4.014 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 4.873 0.986 5.143 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 5.556 1.851 6.074 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 7.049 1.568 6.212 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 7.951 2.686 5.696 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 9.001 2.232 4.684 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 3.487 4.544 4.451 0.00 0.00 0.294 C ATOM 15 O UNL d 1 3.719 4.741 5.631 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 2.287 4.684 3.829 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 1.641 5.965 3.947 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 0.176 5.842 4.366 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 -0.177 6.698 5.582 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 0.910 6.638 6.648 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10