REMARK VINA RESULT: -0.7 0.000 0.000 REMARK 4 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_14 REMARK 2 A between atoms: O_2 and C_15 REMARK 3 A between atoms: C_3 and C_4 REMARK 4 A between atoms: C_3 and C_5 ROOT ATOM 1 C UNL d 1 4.274 -3.601 12.676 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 4.266 -4.897 13.459 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 4.639 -4.923 14.812 0.00 0.00 0.010 A ATOM 4 C UNL d 1 4.680 -6.129 15.520 0.00 0.00 0.037 A ATOM 5 C UNL d 1 4.355 -7.315 14.870 0.00 0.00 0.065 A ATOM 6 C UNL d 1 3.972 -7.311 13.537 0.00 0.00 0.037 A ATOM 7 C UNL d 1 3.924 -6.106 12.831 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 4.401 -8.516 15.513 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 4.766 -9.179 14.903 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 4.785 -3.762 11.260 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 3.957 -3.469 10.165 0.00 0.00 0.010 A ATOM 12 C UNL d 1 4.391 -3.705 8.857 0.00 0.00 0.037 A ATOM 13 C UNL d 1 5.662 -4.224 8.641 0.00 0.00 0.065 A ATOM 14 C UNL d 1 6.514 -4.481 9.708 0.00 0.00 0.037 A ATOM 15 C UNL d 1 6.075 -4.257 11.015 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 6.114 -4.495 7.382 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 6.427 -3.666 6.986 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4