REMARK VINA RESULT: -8.4 2.154 5.666 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 -2.860 -4.395 6.996 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -2.245 -5.621 6.696 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -3.967 -4.358 7.857 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -2.795 -6.804 7.212 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -4.492 -5.541 8.379 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -3.917 -6.764 8.045 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -1.049 -5.747 5.829 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -0.951 -5.179 4.752 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -0.161 -6.610 6.375 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 1.138 -6.646 5.764 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 1.835 -7.891 6.238 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 3.028 -7.794 6.965 0.00 0.00 0.009 A ATOM 13 C UNL d 1 3.797 -8.931 7.207 0.00 0.00 0.001 A ATOM 14 C UNL d 1 3.372 -10.171 6.735 0.00 0.00 0.000 A ATOM 15 C UNL d 1 2.155 -10.287 6.067 0.00 0.00 0.001 A ATOM 16 C UNL d 1 1.383 -9.151 5.825 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 -2.468 -3.114 6.362 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -2.788 -2.788 5.235 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -1.597 -2.495 7.187 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -1.254 -1.132 6.899 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 0.254 -1.071 6.680 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 0.600 -1.238 5.198 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 1.210 -2.593 4.891 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9