REMARK VINA RESULT: -4.4 1.763 5.452 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 -3.561 -15.804 6.493 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -3.624 -14.634 5.720 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -4.627 -16.145 7.339 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -4.731 -13.783 5.861 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -5.731 -15.299 7.455 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -5.777 -14.111 6.728 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -2.562 -14.219 4.773 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -1.441 -13.897 5.136 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -3.044 -14.193 3.508 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -3.010 -15.440 2.796 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -4.421 -15.952 2.700 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -5.447 -15.106 2.262 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -6.779 -15.493 2.388 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -7.093 -16.733 2.942 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -6.077 -17.608 3.322 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -4.743 -17.223 3.194 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 -2.362 -16.673 6.552 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -1.398 -16.453 7.259 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -2.487 -17.614 5.592 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -1.340 -18.420 5.291 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -0.584 -17.742 4.153 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -0.920 -18.391 2.808 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -0.299 -19.768 2.654 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9