REMARK VINA RESULT: -7.1 1.820 4.178 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 -0.195 -1.069 3.216 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -0.813 0.036 2.612 0.00 0.00 0.055 A ATOM 3 C UNL d 1 0.559 -1.962 2.441 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -0.722 0.192 1.221 0.00 0.00 0.018 A ATOM 5 C UNL d 1 0.658 -1.785 1.060 0.00 0.00 0.001 A ATOM 6 C UNL d 1 0.006 -0.718 0.448 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -1.595 1.050 3.361 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -1.081 1.830 4.148 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -2.914 0.921 3.090 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -3.616 -0.083 3.840 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -5.056 0.338 3.935 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -5.542 1.368 3.120 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -6.799 1.919 3.359 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -7.583 1.436 4.405 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -7.135 0.369 5.181 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -5.878 -0.185 4.942 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 -0.380 -1.421 4.644 0.00 0.00 0.294 C ATOM 18 O UNL d 1 0.277 -0.947 5.551 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -1.265 -2.439 4.707 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -1.908 -2.690 5.965 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -3.082 -3.628 5.704 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -3.413 -3.689 4.211 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -4.907 -3.706 3.945 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9