REMARK VINA RESULT: -5.1 1.632 5.164 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 -3.593 13.446 -15.331 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -2.783 14.395 -15.973 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -4.712 12.917 -15.990 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -3.148 14.853 -17.247 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -5.054 13.367 -17.267 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -4.282 14.345 -17.889 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -1.561 14.976 -15.365 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -1.585 15.972 -14.658 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -0.465 14.290 -15.765 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 0.616 14.228 -14.822 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 1.861 14.702 -15.519 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 3.016 14.986 -14.778 0.00 0.00 0.009 A ATOM 13 C UNL d 1 4.091 15.640 -15.376 0.00 0.00 0.001 A ATOM 14 C UNL d 1 4.023 16.004 -16.720 0.00 0.00 0.000 A ATOM 15 C UNL d 1 2.905 15.668 -17.481 0.00 0.00 0.001 A ATOM 16 C UNL d 1 1.829 15.012 -16.885 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 -3.396 13.033 -13.921 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -3.403 13.803 -12.980 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -3.063 11.724 -13.918 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -1.672 11.387 -14.018 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -1.541 10.266 -15.044 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -2.610 9.193 -14.822 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -2.046 7.786 -14.884 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9