REMARK VINA RESULT: -6.5 1.689 3.019 REMARK 8 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_4 and C_16 REMARK 2 A between atoms: O_4 and C_17 REMARK 3 A between atoms: O_5 and C_20 REMARK 4 A between atoms: N_6 and C_10 REMARK 5 A between atoms: N_7 and C_23 REMARK 6 A between atoms: N_7 and C_24 REMARK 7 A between atoms: C_10 and C_13 REMARK 8 A between atoms: C_13 and C_16 ROOT ATOM 1 N UNL d 1 8.939 -10.460 -5.065 0.00 0.00 -0.241 NA ATOM 2 N UNL d 1 8.619 -9.520 -2.917 0.00 0.00 -0.224 NA ATOM 3 C UNL d 1 8.937 -6.670 -6.886 0.00 0.00 0.103 C ATOM 4 C UNL d 1 8.830 -8.071 -4.843 0.00 0.00 0.042 C ATOM 5 C UNL d 1 8.921 -6.797 -5.490 0.00 0.00 0.057 C ATOM 6 C UNL d 1 8.767 -7.850 -7.622 0.00 0.00 0.103 C ATOM 7 C UNL d 1 8.897 -9.236 -5.605 0.00 0.00 0.075 C ATOM 8 C UNL d 1 8.829 -9.102 -6.975 0.00 0.00 0.072 C ATOM 9 C UNL d 1 8.579 -8.295 -3.477 0.00 0.00 0.142 C ATOM 10 C UNL d 1 8.841 -10.545 -3.732 0.00 0.00 0.236 C ENDROOT BRANCH 3 11 ATOM 11 O UNL d 1 9.040 -5.439 -7.514 0.00 0.00 -0.348 OA BRANCH 11 12 ATOM 12 C UNL d 1 10.075 -4.576 -7.005 0.00 0.00 0.177 C BRANCH 12 13 ATOM 13 C UNL d 1 9.924 -3.082 -7.355 0.00 0.00 0.057 C BRANCH 13 14 ATOM 14 C UNL d 1 8.551 -2.395 -7.525 0.00 0.00 0.274 C BRANCH 14 15 ATOM 15 N UNL d 1 8.178 -1.794 -8.826 0.00 0.00 0.092 N ATOM 16 C UNL d 1 6.738 -1.471 -8.927 0.00 0.00 0.298 C ATOM 17 C UNL d 1 5.830 -2.709 -8.865 0.00 0.00 0.198 C ATOM 18 O UNL d 1 6.139 -3.641 -9.909 0.00 0.00 -0.388 OA ATOM 19 C UNL d 1 7.527 -4.004 -9.908 0.00 0.00 0.198 C ATOM 20 C UNL d 1 8.439 -2.761 -9.941 0.00 0.00 0.298 C ENDBRANCH 14 15 ENDBRANCH 13 14 ENDBRANCH 12 13 ENDBRANCH 11 12 ENDBRANCH 3 11 BRANCH 6 21 ATOM 21 O UNL d 1 8.530 -7.988 -8.964 0.00 0.00 -0.353 OA ATOM 22 C UNL d 1 9.386 -8.853 -9.690 0.00 0.00 0.210 C ENDBRANCH 6 21 BRANCH 9 23 ATOM 23 N UNL d 1 8.097 -7.229 -2.695 0.00 0.00 -0.340 N ATOM 24 H UNL d 1 8.828 -6.712 -2.237 0.00 0.00 0.167 HD BRANCH 23 25 ATOM 25 C UNL d 1 6.799 -7.070 -2.188 0.00 0.00 0.035 A ATOM 26 C UNL d 1 5.769 -7.980 -2.485 0.00 0.00 0.056 A ATOM 27 C UNL d 1 4.479 -7.790 -1.988 0.00 0.00 0.074 A ATOM 28 CL UNL d 1 3.250 -8.937 -2.362 0.00 0.00 -0.081 Cl ATOM 29 C UNL d 1 4.201 -6.677 -1.209 0.00 0.00 0.138 A ATOM 30 F UNL d 1 2.972 -6.478 -0.710 0.00 0.00 -0.204 F ATOM 31 C UNL d 1 5.194 -5.741 -0.936 0.00 0.00 0.046 A ATOM 32 C UNL d 1 6.485 -5.933 -1.432 0.00 0.00 0.032 A ENDBRANCH 23 25 ENDBRANCH 9 23 TORSDOF 8