REMARK VINA RESULT: -2.8 2.079 2.747 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 -8.642 -3.361 2.375 0.00 0.00 0.104 N ATOM 2 H UNL d 1 -9.608 -3.671 2.559 0.00 0.00 0.317 HD ENDROOT BRANCH 1 3 ATOM 3 C UNL d 1 -8.679 -2.722 1.029 0.00 0.00 0.394 C BRANCH 3 4 ATOM 4 P UNL d 1 -7.452 -3.480 -0.044 0.00 0.00 0.264 P ATOM 5 O UNL d 1 -7.577 -4.952 -0.264 0.00 0.00 -0.652 OA BRANCH 4 6 ATOM 6 O UNL d 1 -7.533 -2.601 -1.380 0.00 0.00 -0.328 OA ATOM 7 H UNL d 1 -7.493 -3.147 -2.188 0.00 0.00 0.220 HD ENDBRANCH 4 6 BRANCH 4 8 ATOM 8 O UNL d 1 -6.032 -3.029 0.556 0.00 0.00 -0.328 OA ATOM 9 H UNL d 1 -5.664 -3.672 1.191 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 -8.320 -2.260 3.340 0.00 0.00 0.379 C BRANCH 10 11 ATOM 11 C UNL d 1 -7.004 -2.498 4.066 0.00 0.00 0.168 C ATOM 12 O UNL d 1 -6.009 -2.977 3.548 0.00 0.00 -0.649 OA BRANCH 11 13 ATOM 13 O UNL d 1 -7.066 -2.163 5.376 0.00 0.00 -0.775 OA ATOM 14 H UNL d 1 -6.153 -2.013 5.701 0.00 0.00 0.167 HD ENDBRANCH 11 13 ENDBRANCH 10 11 ENDBRANCH 1 10 TORSDOF 7