REMARK VINA RESULT: -6.1 2.079 4.138 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 -4.645 -2.791 -0.046 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -4.241 -3.644 0.993 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -3.696 -2.018 -0.730 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -2.892 -3.658 1.377 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -2.353 -2.056 -0.350 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -1.953 -2.863 0.711 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -5.171 -4.523 1.741 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -5.516 -5.621 1.330 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -5.604 -3.903 2.863 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -5.482 -4.652 4.083 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -4.095 -4.430 4.620 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -3.622 -3.128 4.825 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -2.274 -2.906 5.099 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -1.394 -3.984 5.182 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -1.868 -5.287 5.043 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -3.217 -5.511 4.771 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 -6.066 -2.570 -0.406 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -6.715 -3.323 -1.107 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -6.420 -1.346 0.043 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -7.183 -1.273 1.255 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -6.613 -0.133 2.093 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -5.434 -0.615 2.943 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -4.101 -0.093 2.440 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9