REMARK VINA RESULT: -7.9 2.238 7.198 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 -2.060 -5.314 6.511 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -2.506 -4.046 6.914 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -2.657 -6.468 7.038 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -3.503 -3.955 7.897 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -3.661 -6.364 8.001 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -4.074 -5.109 8.442 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -1.960 -2.776 6.380 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -2.580 -2.064 5.604 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -0.694 -2.585 6.820 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -0.024 -1.417 6.321 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 0.886 -1.850 5.206 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 1.597 -3.053 5.307 0.00 0.00 0.009 A ATOM 13 C UNL d 1 2.609 -3.349 4.396 0.00 0.00 0.001 A ATOM 14 C UNL d 1 2.908 -2.452 3.373 0.00 0.00 0.000 A ATOM 15 C UNL d 1 2.163 -1.283 3.226 0.00 0.00 0.001 A ATOM 16 C UNL d 1 1.149 -0.986 4.135 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 -0.895 -5.516 5.617 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -0.784 -5.005 4.519 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -0.107 -6.461 6.174 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 1.175 -6.701 5.577 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 1.882 -7.764 6.411 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 1.365 -9.163 6.067 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 2.338 -9.950 5.208 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9