REMARK VINA RESULT: -4.2 0.000 0.000 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 -4.452 -4.378 7.770 0.00 0.00 0.104 N ATOM 2 H UNL d 1 -5.225 -3.707 7.901 0.00 0.00 0.317 HD ENDROOT BRANCH 1 3 ATOM 3 C UNL d 1 -3.213 -3.632 8.131 0.00 0.00 0.394 C BRANCH 3 4 ATOM 4 P UNL d 1 -2.217 -3.351 6.660 0.00 0.00 0.264 P ATOM 5 O UNL d 1 -1.262 -2.204 6.711 0.00 0.00 -0.652 OA BRANCH 4 6 ATOM 6 O UNL d 1 -1.530 -4.774 6.400 0.00 0.00 -0.328 OA ATOM 7 H UNL d 1 -2.184 -5.477 6.223 0.00 0.00 0.220 HD ENDBRANCH 4 6 BRANCH 4 8 ATOM 8 O UNL d 1 -3.268 -3.271 5.449 0.00 0.00 -0.328 OA ATOM 9 H UNL d 1 -4.159 -2.992 5.734 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 -4.596 -5.453 8.804 0.00 0.00 0.379 C BRANCH 10 11 ATOM 11 C UNL d 1 -4.071 -6.795 8.315 0.00 0.00 0.168 C ATOM 12 O UNL d 1 -3.417 -6.949 7.297 0.00 0.00 -0.649 OA BRANCH 11 13 ATOM 13 O UNL d 1 -4.448 -7.822 9.112 0.00 0.00 -0.775 OA ATOM 14 H UNL d 1 -5.105 -7.487 9.760 0.00 0.00 0.167 HD ENDBRANCH 11 13 ENDBRANCH 10 11 ENDBRANCH 1 10 TORSDOF 7