REMARK VINA RESULT: -4.2 1.984 3.086 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 17.678 -32.171 -4.284 0.00 0.00 0.055 A ATOM 2 C UNL d 1 18.811 -32.229 -3.459 0.00 0.00 0.055 A ATOM 3 C UNL d 1 17.533 -31.125 -5.206 0.00 0.00 0.018 A ATOM 4 C UNL d 1 19.754 -31.192 -3.523 0.00 0.00 0.018 A ATOM 5 C UNL d 1 18.489 -30.109 -5.274 0.00 0.00 0.001 A ATOM 6 C UNL d 1 19.591 -30.134 -4.423 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 19.063 -33.318 -2.486 0.00 0.00 0.294 C ATOM 8 O UNL d 1 19.471 -34.420 -2.820 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 18.714 -32.926 -1.239 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 19.669 -33.202 -0.202 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 20.486 -31.958 0.013 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 19.859 -30.762 0.386 0.00 0.00 0.009 A ATOM 13 C UNL d 1 20.566 -29.562 0.361 0.00 0.00 0.001 A ATOM 14 C UNL d 1 21.905 -29.551 -0.024 0.00 0.00 0.000 A ATOM 15 C UNL d 1 22.554 -30.744 -0.335 0.00 0.00 0.001 A ATOM 16 C UNL d 1 21.850 -31.946 -0.309 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 16.541 -33.116 -4.167 0.00 0.00 0.294 C ATOM 18 O UNL d 1 16.573 -34.268 -4.553 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 15.473 -32.422 -3.718 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 15.423 -32.100 -2.321 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 15.494 -30.582 -2.193 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 16.623 -30.165 -1.248 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 17.315 -28.889 -1.693 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9