REMARK VINA RESULT: -6.9 1.109 4.538 REMARK 10 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_9 REMARK 2 A between atoms: O_1 and C_15 REMARK 3 A between atoms: O_2 and C_10 REMARK 4 A between atoms: O_2 and C_16 REMARK 5 A between atoms: C_5 and C_7 REMARK 6 A between atoms: C_5 and C_9 REMARK 7 A between atoms: C_6 and C_8 REMARK 8 A between atoms: C_6 and C_10 REMARK 9 A between atoms: C_11 and C_15 REMARK 10 A between atoms: C_12 and C_16 ROOT ATOM 1 C UNL d 1 -3.675 -4.420 7.666 0.00 0.00 0.055 C ATOM 2 C UNL d 1 -3.576 -5.814 7.778 0.00 0.00 0.055 C ATOM 3 C UNL d 1 -4.526 -3.716 8.538 0.00 0.00 0.018 C ATOM 4 C UNL d 1 -4.461 -6.498 8.623 0.00 0.00 0.018 C ATOM 5 C UNL d 1 -5.360 -4.402 9.421 0.00 0.00 0.001 C ATOM 6 C UNL d 1 -5.363 -5.794 9.428 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 -3.096 -3.629 6.551 0.00 0.00 0.294 C ATOM 8 O UNL d 1 -3.344 -3.866 5.381 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 -2.098 -2.844 7.025 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 -2.165 -1.424 6.777 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 -0.840 -0.801 6.348 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 0.245 -1.815 5.994 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 0.942 -1.550 4.661 0.00 0.00 0.005 C ENDBRANCH 11 12 ENDBRANCH 10 11 ENDBRANCH 9 10 ENDBRANCH 7 9 ENDBRANCH 1 7 BRANCH 2 14 ATOM 14 C UNL d 1 -2.573 -6.610 7.046 0.00 0.00 0.294 C ATOM 15 O UNL d 1 -2.820 -7.669 6.495 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 -1.348 -6.039 7.187 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 -0.346 -6.409 6.223 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 -0.199 -5.373 5.108 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 1.230 -5.251 4.582 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 2.127 -6.357 5.126 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10