REMARK VINA RESULT: -5.4 1.587 7.425 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 30.216 4.867 -43.062 0.00 0.00 0.055 A ATOM 2 C UNL d 1 31.167 4.159 -42.310 0.00 0.00 0.055 A ATOM 3 C UNL d 1 29.506 4.220 -44.084 0.00 0.00 0.018 A ATOM 4 C UNL d 1 31.442 2.825 -42.643 0.00 0.00 0.018 A ATOM 5 C UNL d 1 29.776 2.886 -44.392 0.00 0.00 0.001 A ATOM 6 C UNL d 1 30.753 2.192 -43.683 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 31.932 4.753 -41.188 0.00 0.00 0.294 C ATOM 8 O UNL d 1 31.438 5.541 -40.396 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 33.222 4.348 -41.232 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 33.809 3.979 -39.973 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 34.159 2.518 -40.041 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 34.481 1.819 -38.870 0.00 0.00 0.009 A ATOM 13 C UNL d 1 35.027 0.539 -38.945 0.00 0.00 0.001 A ATOM 14 C UNL d 1 35.243 -0.054 -40.188 0.00 0.00 0.000 A ATOM 15 C UNL d 1 34.866 0.609 -41.354 0.00 0.00 0.001 A ATOM 16 C UNL d 1 34.318 1.888 -41.282 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 29.982 6.323 -42.909 0.00 0.00 0.294 C ATOM 18 O UNL d 1 30.862 7.161 -42.958 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 28.689 6.499 -42.562 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 27.914 7.438 -43.320 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 27.934 8.766 -42.569 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 28.257 9.924 -43.516 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 29.659 9.835 -44.090 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9