REMARK VINA RESULT: -4.4 1.964 2.126 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 7.264 -6.991 -2.475 0.00 0.00 0.104 N ATOM 2 H UNL d 1 7.273 -5.969 -2.340 0.00 0.00 0.317 HD ENDROOT BRANCH 1 3 ATOM 3 C UNL d 1 6.053 -7.274 -3.297 0.00 0.00 0.394 C BRANCH 3 4 ATOM 4 P UNL d 1 4.646 -7.595 -2.224 0.00 0.00 0.264 P ATOM 5 O UNL d 1 3.936 -8.893 -2.427 0.00 0.00 -0.652 OA BRANCH 4 6 ATOM 6 O UNL d 1 5.247 -7.391 -0.754 0.00 0.00 -0.328 OA ATOM 7 H UNL d 1 4.629 -6.923 -0.161 0.00 0.00 0.220 HD ENDBRANCH 4 6 BRANCH 4 8 ATOM 8 O UNL d 1 3.702 -6.304 -2.371 0.00 0.00 -0.328 OA ATOM 9 H UNL d 1 3.919 -5.598 -1.734 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 8.435 -7.351 -3.340 0.00 0.00 0.379 C BRANCH 10 11 ATOM 11 C UNL d 1 8.509 -8.847 -3.613 0.00 0.00 0.168 C ATOM 12 O UNL d 1 8.797 -9.335 -4.694 0.00 0.00 -0.649 OA BRANCH 11 13 ATOM 13 O UNL d 1 8.173 -9.590 -2.533 0.00 0.00 -0.775 OA ATOM 14 H UNL d 1 7.339 -9.234 -2.159 0.00 0.00 0.167 HD ENDBRANCH 11 13 ENDBRANCH 10 11 ENDBRANCH 1 10 TORSDOF 7