REMARK VINA RESULT: -8.4 1.395 5.534 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 -3.690 -4.478 7.642 0.00 0.00 0.055 A ATOM 2 C UNL d 1 -3.477 -5.859 7.778 0.00 0.00 0.055 A ATOM 3 C UNL d 1 -4.606 -3.823 8.479 0.00 0.00 0.018 A ATOM 4 C UNL d 1 -4.241 -6.577 8.710 0.00 0.00 0.018 A ATOM 5 C UNL d 1 -5.346 -4.548 9.415 0.00 0.00 0.001 A ATOM 6 C UNL d 1 -5.175 -5.926 9.521 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 -2.501 -6.621 6.964 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -2.786 -7.666 6.398 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -1.284 -6.031 7.012 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 -0.634 -5.826 5.747 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 0.725 -6.463 5.821 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 1.767 -5.992 5.012 0.00 0.00 0.009 A ATOM 13 C UNL d 1 2.953 -6.714 4.903 0.00 0.00 0.001 A ATOM 14 C UNL d 1 3.110 -7.905 5.610 0.00 0.00 0.000 A ATOM 15 C UNL d 1 2.105 -8.348 6.467 0.00 0.00 0.001 A ATOM 16 C UNL d 1 0.918 -7.626 6.579 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 -3.068 -3.663 6.572 0.00 0.00 0.294 C ATOM 18 O UNL d 1 -3.328 -3.782 5.390 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 -2.091 -2.920 7.134 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 -1.954 -1.558 6.705 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 -0.483 -1.177 6.836 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 0.191 -1.115 5.464 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 0.915 -2.402 5.110 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9