REMARK VINA RESULT: -6.6 1.553 2.027 REMARK 3 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: N_6 and C_13 REMARK 2 A between atoms: N_8 and N_10 REMARK 3 A between atoms: C_13 and C_15 ROOT ATOM 1 O UNL d 1 -14.734 22.521 -25.028 0.00 0.00 -0.352 OA ATOM 2 N UNL d 1 -16.178 21.067 -26.219 0.00 0.00 -0.188 N ATOM 3 N UNL d 1 -14.321 21.867 -27.214 0.00 0.00 -0.198 N ATOM 4 N UNL d 1 -15.900 20.967 -28.633 0.00 0.00 0.083 NA ATOM 5 C UNL d 1 -16.072 22.081 -25.187 0.00 0.00 0.314 C ATOM 6 C UNL d 1 -15.537 21.261 -27.424 0.00 0.00 0.725 C ATOM 7 C UNL d 1 -14.239 22.955 -26.279 0.00 0.00 0.313 C ATOM 8 C UNL d 1 -13.103 21.451 -27.878 0.00 0.00 0.171 C ENDROOT BRANCH 2 9 ATOM 9 C UNL d 1 -16.497 19.707 -25.759 0.00 0.00 0.191 C BRANCH 9 10 ATOM 10 C UNL d 1 -17.953 19.385 -25.562 0.00 0.00 0.021 A ATOM 11 S UNL d 1 -18.809 19.990 -24.190 0.00 0.00 -0.060 SA ATOM 12 C UNL d 1 -20.216 19.226 -24.757 0.00 0.00 0.167 A ATOM 13 CL UNL d 1 -21.689 19.386 -23.891 0.00 0.00 -0.054 Cl ATOM 14 N UNL d 1 -20.120 18.530 -25.860 0.00 0.00 -0.240 NA ATOM 15 C UNL d 1 -18.818 18.618 -26.321 0.00 0.00 0.135 A ENDBRANCH 9 10 ENDBRANCH 2 9 BRANCH 4 16 ATOM 16 N UNL d 1 -17.166 20.582 -28.855 0.00 0.00 0.001 N ATOM 17 O UNL d 1 -18.118 21.354 -28.651 0.00 0.00 -0.515 OA ATOM 18 O UNL d 1 -17.336 19.450 -29.339 0.00 0.00 -0.515 OA ENDBRANCH 4 16 TORSDOF 3