REMARK VINA RESULT: -6.1 3.919 7.401 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 8.824 -8.742 -9.096 0.00 0.00 -0.241 NA ATOM 2 N UNL d 1 8.688 -6.429 -9.577 0.00 0.00 -0.224 NA ATOM 3 C UNL d 1 8.323 -8.065 -4.976 0.00 0.00 0.103 C ATOM 4 C UNL d 1 8.443 -7.198 -7.296 0.00 0.00 0.042 C ATOM 5 C UNL d 1 8.190 -7.017 -5.898 0.00 0.00 0.057 C ATOM 6 C UNL d 1 8.807 -9.280 -5.478 0.00 0.00 0.103 C ATOM 7 C UNL d 1 8.696 -8.476 -7.790 0.00 0.00 0.075 C ATOM 8 C UNL d 1 8.907 -9.481 -6.870 0.00 0.00 0.072 C ATOM 9 C UNL d 1 8.561 -6.179 -8.259 0.00 0.00 0.142 C ATOM 10 C UNL d 1 8.770 -7.704 -9.940 0.00 0.00 0.236 C ENDROOT BRANCH 3 11 ATOM 11 O UNL d 1 8.064 -7.896 -3.625 0.00 0.00 -0.348 OA BRANCH 11 12 ATOM 12 C UNL d 1 8.529 -6.655 -3.061 0.00 0.00 0.177 C BRANCH 12 13 ATOM 13 C UNL d 1 7.863 -6.238 -1.735 0.00 0.00 0.057 C BRANCH 13 14 ATOM 14 C UNL d 1 6.337 -6.059 -1.584 0.00 0.00 0.274 C BRANCH 14 15 ATOM 15 N UNL d 1 5.549 -7.035 -0.797 0.00 0.00 0.092 N ATOM 16 C UNL d 1 5.267 -8.286 -1.534 0.00 0.00 0.298 C ATOM 17 C UNL d 1 4.385 -8.077 -2.775 0.00 0.00 0.198 C ATOM 18 O UNL d 1 3.126 -7.483 -2.433 0.00 0.00 -0.388 OA ATOM 19 C UNL d 1 3.293 -6.265 -1.693 0.00 0.00 0.198 C ATOM 20 C UNL d 1 4.201 -6.468 -0.463 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 9.230 -10.380 -4.780 0.00 0.00 -0.353 OA ATOM 22 C UNL d 1 8.271 -11.054 -3.983 0.00 0.00 0.210 C ENDBRANCH 6 21 BRANCH 9 23 ATOM 23 N UNL d 1 8.728 -4.852 -7.821 0.00 0.00 -0.340 N ATOM 24 H UNL d 1 8.044 -4.221 -8.201 0.00 0.00 0.167 HD BRANCH 23 25 ATOM 25 C UNL d 1 9.892 -4.276 -7.290 0.00 0.00 0.035 A ATOM 26 C UNL d 1 10.110 -4.184 -5.905 0.00 0.00 0.056 A ATOM 27 C UNL d 1 11.266 -3.586 -5.399 0.00 0.00 0.074 A ATOM 28 CL UNL d 1 11.503 -3.511 -3.696 0.00 0.00 -0.081 Cl ATOM 29 C UNL d 1 12.202 -3.055 -6.273 0.00 0.00 0.138 A ATOM 30 F UNL d 1 13.326 -2.486 -5.813 0.00 0.00 -0.204 F ATOM 31 C UNL d 1 11.988 -3.097 -7.648 0.00 0.00 0.046 A ATOM 32 C UNL d 1 10.833 -3.697 -8.153 0.00 0.00 0.032 A ENDBRANCH 23 25 ENDBRANCH 9 23 TORSDOF 8