REMARK VINA RESULT: -3.5 1.845 4.173 REMARK 7 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: P_1 and O_2 REMARK 2 A between atoms: P_1 and O_3 REMARK 3 A between atoms: P_1 and C_8 REMARK 4 A between atoms: O_5 and C_10 REMARK 5 A between atoms: N_7 and C_8 REMARK 6 A between atoms: N_7 and C_9 REMARK 7 A between atoms: C_9 and C_10 ROOT ATOM 1 N UNL d 1 -5.403 -2.962 2.808 0.00 0.00 0.104 N ATOM 2 H UNL d 1 -6.216 -2.613 3.339 0.00 0.00 0.317 HD ENDROOT BRANCH 1 3 ATOM 3 C UNL d 1 -5.663 -2.588 1.389 0.00 0.00 0.394 C BRANCH 3 4 ATOM 4 P UNL d 1 -7.020 -1.412 1.304 0.00 0.00 0.264 P ATOM 5 O UNL d 1 -7.925 -1.523 0.121 0.00 0.00 -0.652 OA BRANCH 4 6 ATOM 6 O UNL d 1 -7.752 -1.589 2.717 0.00 0.00 -0.328 OA ATOM 7 H UNL d 1 -8.695 -1.822 2.621 0.00 0.00 0.220 HD ENDBRANCH 4 6 BRANCH 4 8 ATOM 8 O UNL d 1 -6.338 0.032 1.470 0.00 0.00 -0.328 OA ATOM 9 H UNL d 1 -6.323 0.343 2.395 0.00 0.00 0.220 HD ENDBRANCH 4 8 ENDBRANCH 3 4 ENDBRANCH 1 3 BRANCH 1 10 ATOM 10 C UNL d 1 -4.205 -2.163 3.226 0.00 0.00 0.379 C BRANCH 10 11 ATOM 11 C UNL d 1 -4.506 -1.253 4.409 0.00 0.00 0.168 C ATOM 12 O UNL d 1 -5.455 -0.488 4.466 0.00 0.00 -0.649 OA BRANCH 11 13 ATOM 13 O UNL d 1 -3.574 -1.347 5.387 0.00 0.00 -0.775 OA ATOM 14 H UNL d 1 -4.000 -1.128 6.243 0.00 0.00 0.167 HD ENDBRANCH 11 13 ENDBRANCH 10 11 ENDBRANCH 1 10 TORSDOF 7