REMARK VINA RESULT: -6.2 1.579 4.483 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 -2.083 -1.950 -0.743 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -3.005 -2.564 -1.604 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -0.736 -2.341 -0.762 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -2.574 -3.615 -2.427 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -0.316 -3.375 -1.600 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -1.236 -4.022 -2.421 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -4.436 -2.186 -1.677 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -4.853 -1.321 -2.432 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -5.154 -2.878 -0.761 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -6.187 -2.143 -0.085 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 -6.005 -2.351 1.393 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 -6.106 -1.265 2.272 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -5.715 -1.400 3.602 0.00 0.00 0.001 A ATOM 14 C UNL d 1 -5.232 -2.623 4.065 0.00 0.00 0.000 A ATOM 15 C UNL d 1 -5.189 -3.725 3.214 0.00 0.00 0.001 A ATOM 16 C UNL d 1 -5.582 -3.593 1.883 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 -2.472 -0.959 0.289 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -2.415 0.245 0.129 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -2.730 -1.632 1.431 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -2.049 -1.215 2.622 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -1.348 -2.438 3.205 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 -1.748 -2.653 4.667 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 -1.586 -4.095 5.111 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9