REMARK VINA RESULT: -4.9 1.920 2.899 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 8.370 -8.609 -5.101 0.00 0.00 0.055 A ATOM 2 C UNL d 1 8.576 -8.253 -3.759 0.00 0.00 0.055 A ATOM 3 C UNL d 1 8.420 -9.957 -5.485 0.00 0.00 0.018 A ATOM 4 C UNL d 1 8.899 -9.253 -2.830 0.00 0.00 0.018 A ATOM 5 C UNL d 1 8.724 -10.945 -4.547 0.00 0.00 0.001 A ATOM 6 C UNL d 1 8.978 -10.593 -3.224 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 8.502 -6.859 -3.260 0.00 0.00 0.294 C ATOM 8 O UNL d 1 9.326 -6.007 -3.555 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 7.459 -6.719 -2.408 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 6.190 -7.192 -2.885 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 5.134 -6.721 -1.924 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 5.216 -7.061 -0.568 0.00 0.00 0.009 A ATOM 13 C UNL d 1 4.135 -6.830 0.281 0.00 0.00 0.001 A ATOM 14 C UNL d 1 2.972 -6.248 -0.217 0.00 0.00 0.000 A ATOM 15 C UNL d 1 2.905 -5.848 -1.551 0.00 0.00 0.001 A ATOM 16 C UNL d 1 3.985 -6.076 -2.401 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 8.202 -7.614 -6.187 0.00 0.00 0.294 C ATOM 18 O UNL d 1 7.124 -7.273 -6.635 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 9.429 -7.306 -6.658 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 9.509 -6.503 -7.844 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 10.131 -5.165 -7.455 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 9.104 -4.262 -6.769 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 7.914 -3.951 -7.658 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9