REMARK VINA RESULT: -4.0 3.313 7.014 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 42.595 67.266 55.519 0.00 0.00 0.055 C ATOM 2 C UNL d 1 43.684 67.117 54.649 0.00 0.00 0.055 C ATOM 3 C UNL d 1 41.991 68.530 55.660 0.00 0.00 0.018 C ATOM 4 C UNL d 1 44.272 68.258 54.085 0.00 0.00 0.018 C ATOM 5 C UNL d 1 42.545 69.652 55.043 0.00 0.00 0.001 C ATOM 6 C UNL d 1 43.714 69.523 54.297 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 42.138 66.224 56.472 0.00 0.00 0.294 C ATOM 8 O UNL d 1 41.074 65.642 56.347 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 42.926 66.243 57.575 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 43.018 65.044 58.373 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 43.620 63.849 57.639 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 44.762 63.164 58.386 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 45.327 63.974 59.551 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 44.253 65.804 54.290 0.00 0.00 0.294 C ATOM 15 O UNL d 1 43.708 65.012 53.541 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 45.388 65.590 55.006 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 45.951 64.267 54.945 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 47.249 64.149 55.745 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 48.503 64.227 54.875 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 48.853 62.875 54.268 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10