REMARK VINA RESULT: -7.3 1.632 5.412 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 -3.811 -3.156 -0.830 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -5.198 -3.030 -0.659 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -3.278 -4.319 -1.405 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -6.028 -4.105 -1.006 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -4.117 -5.375 -1.764 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -5.490 -5.275 -1.551 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -5.848 -1.822 -0.097 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -5.856 -0.746 -0.676 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -6.343 -2.083 1.135 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -7.284 -1.128 1.651 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -7.681 -1.573 3.031 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -6.697 -1.927 3.964 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -7.054 -2.556 5.155 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -8.394 -2.824 5.426 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -9.384 -2.418 4.533 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -9.030 -1.787 3.342 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 -2.838 -2.155 -0.332 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -2.431 -1.217 -0.991 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -2.400 -2.570 0.876 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -2.401 -1.621 1.951 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -3.337 -2.150 3.033 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -2.818 -1.794 4.428 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -1.328 -1.508 4.440 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9