REMARK VINA RESULT: -4.1 2.415 6.163 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 -3.634 -16.007 4.754 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -4.877 -15.357 4.771 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -3.227 -16.716 3.614 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -5.729 -15.486 3.664 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -4.077 -16.821 2.512 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -5.333 -16.220 2.541 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -5.368 -14.554 5.917 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -5.960 -15.048 6.864 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -5.121 -13.239 5.710 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -4.546 -12.526 6.817 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -3.100 -12.271 6.497 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -2.673 -12.224 5.164 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -1.313 -12.220 4.862 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -0.372 -12.252 5.889 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -0.787 -12.234 7.219 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -2.147 -12.235 7.524 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 -2.741 -16.080 5.936 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -1.687 -15.482 6.029 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -3.236 -17.023 6.767 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -2.304 -17.904 7.410 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -2.570 -19.314 6.894 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -1.304 -19.922 6.285 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -0.679 -19.029 5.228 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9