REMARK VINA RESULT: -5.0 0.000 0.000 REMARK 11 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_21 REMARK 2 A between atoms: O_2 and C_22 REMARK 3 A between atoms: O_3 and C_27 REMARK 4 A between atoms: O_4 and C_28 REMARK 5 A between atoms: O_5 and C_29 REMARK 6 A between atoms: O_6 and C_30 REMARK 7 A between atoms: C_9 and C_10 REMARK 8 A between atoms: C_15 and C_19 REMARK 9 A between atoms: C_16 and C_20 REMARK 10 A between atoms: C_25 and C_37 REMARK 11 A between atoms: C_26 and C_38 ROOT ATOM 1 C UNL d 1 6.588 -4.829 -8.742 0.00 0.00 0.017 A ATOM 2 C UNL d 1 3.932 -5.728 -9.598 0.00 0.00 -0.012 A ATOM 3 C UNL d 1 4.145 -4.359 -9.277 0.00 0.00 0.025 A ATOM 4 C UNL d 1 2.629 -6.205 -10.012 0.00 0.00 -0.007 A ATOM 5 C UNL d 1 6.361 -6.160 -9.136 0.00 0.00 -0.047 A ATOM 6 C UNL d 1 5.444 -3.984 -8.774 0.00 0.00 0.089 A ATOM 7 C UNL d 1 5.059 -6.576 -9.497 0.00 0.00 0.020 A ATOM 8 C UNL d 1 3.055 -3.452 -9.455 0.00 0.00 0.051 A ATOM 9 C UNL d 1 1.585 -5.270 -10.108 0.00 0.00 0.107 A ATOM 10 C UNL d 1 1.797 -3.918 -9.854 0.00 0.00 0.113 A ATOM 11 C UNL d 1 7.389 -7.270 -9.149 0.00 0.00 0.049 C ENDROOT BRANCH 1 12 ATOM 12 C UNL d 1 7.942 -4.327 -8.313 0.00 0.00 0.017 A ATOM 13 C UNL d 1 8.748 -3.514 -9.130 0.00 0.00 -0.047 A ATOM 14 C UNL d 1 9.998 -3.057 -8.660 0.00 0.00 0.020 A ATOM 15 C UNL d 1 8.384 -3.001 -10.502 0.00 0.00 0.049 C ATOM 16 C UNL d 1 10.586 -3.421 -7.430 0.00 0.00 -0.012 A ATOM 17 C UNL d 1 9.825 -4.300 -6.607 0.00 0.00 0.025 A ATOM 18 C UNL d 1 11.884 -2.939 -7.012 0.00 0.00 -0.007 A ATOM 19 C UNL d 1 8.494 -4.646 -7.044 0.00 0.00 0.089 A ATOM 20 C UNL d 1 10.426 -4.759 -5.393 0.00 0.00 0.051 A ATOM 21 C UNL d 1 11.673 -4.290 -4.993 0.00 0.00 0.113 A ATOM 22 C UNL d 1 12.381 -3.382 -5.776 0.00 0.00 0.107 A BRANCH 19 23 ATOM 23 O UNL d 1 7.702 -5.285 -6.108 0.00 0.00 -0.359 OA ATOM 24 H UNL d 1 8.253 -5.813 -5.506 0.00 0.00 0.217 HD ENDBRANCH 19 23 BRANCH 20 25 ATOM 25 C UNL d 1 9.806 -5.842 -4.585 0.00 0.00 0.273 C ATOM 26 O UNL d 1 10.035 -7.036 -4.743 0.00 0.00 -0.301 OA ENDBRANCH 20 25 BRANCH 21 27 ATOM 27 O UNL d 1 12.282 -4.738 -3.848 0.00 0.00 -0.357 OA ATOM 28 H UNL d 1 12.999 -5.331 -4.150 0.00 0.00 0.217 HD ENDBRANCH 21 27 BRANCH 22 29 ATOM 29 O UNL d 1 13.591 -3.022 -5.234 0.00 0.00 -0.357 OA ATOM 30 H UNL d 1 14.234 -3.738 -5.326 0.00 0.00 0.217 HD ENDBRANCH 22 29 BRANCH 18 31 ATOM 31 C UNL d 1 12.712 -2.004 -7.906 0.00 0.00 0.014 C ATOM 32 C UNL d 1 13.087 -0.677 -7.234 0.00 0.00 0.015 C ATOM 33 C UNL d 1 13.903 -2.724 -8.548 0.00 0.00 0.015 C ENDBRANCH 18 31 ENDBRANCH 1 12 BRANCH 6 34 ATOM 34 O UNL d 1 5.536 -2.710 -8.242 0.00 0.00 -0.359 OA ATOM 35 H UNL d 1 6.468 -2.449 -8.147 0.00 0.00 0.217 HD ENDBRANCH 6 34 BRANCH 8 36 ATOM 36 C UNL d 1 3.240 -1.985 -9.361 0.00 0.00 0.273 C ATOM 37 O UNL d 1 3.465 -1.253 -10.317 0.00 0.00 -0.301 OA ENDBRANCH 8 36 BRANCH 4 38 ATOM 38 C UNL d 1 2.397 -7.680 -10.373 0.00 0.00 0.014 C ATOM 39 C UNL d 1 3.689 -8.494 -10.504 0.00 0.00 0.015 C ATOM 40 C UNL d 1 1.349 -8.336 -9.468 0.00 0.00 0.015 C ENDBRANCH 4 38 BRANCH 10 41 ATOM 41 O UNL d 1 0.745 -3.066 -10.069 0.00 0.00 -0.357 OA ATOM 42 H UNL d 1 1.111 -2.169 -9.937 0.00 0.00 0.217 HD ENDBRANCH 10 41 BRANCH 9 43 ATOM 43 O UNL d 1 0.297 -5.554 -10.496 0.00 0.00 -0.357 OA ATOM 44 H UNL d 1 0.246 -5.682 -11.453 0.00 0.00 0.217 HD ENDBRANCH 9 43 TORSDOF 11