REMARK VINA RESULT: -8.0 0.133 1.254 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 2.223 5.277 2.859 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 3.454 4.406 2.995 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 4.717 4.881 2.610 0.00 0.00 0.010 A ATOM 4 C UNL d 1 5.846 4.057 2.687 0.00 0.00 0.037 A ATOM 5 C UNL d 1 5.708 2.751 3.143 0.00 0.00 0.065 A ATOM 6 C UNL d 1 4.471 2.264 3.539 0.00 0.00 0.037 A ATOM 7 C UNL d 1 3.345 3.089 3.469 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 6.774 1.904 3.216 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 6.609 1.147 2.629 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 1.721 5.814 4.182 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 2.600 5.978 5.265 0.00 0.00 0.010 A ATOM 12 C UNL d 1 2.124 6.383 6.516 0.00 0.00 0.037 A ATOM 13 C UNL d 1 0.768 6.638 6.684 0.00 0.00 0.065 A ATOM 14 C UNL d 1 -0.113 6.523 5.615 0.00 0.00 0.037 A ATOM 15 C UNL d 1 0.361 6.105 4.369 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 0.259 7.008 7.894 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 -0.534 6.475 8.067 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4