; ; C06F12 System Topology File ; [ defaults ] ; nbfunc com-rule gen-pairs fudgeLJ fudgeQ 1 2 yes 0.5000 0.8333 ; ; Force Field Topology File(s) to be included: ;#include "ff_C06F12.itp" ;#include "ff_amber_perF.itp" #include "ff_amber_perHC.itp" ; ; Molecule Topology File(s) to be included: #include "C06H12.itp" [ system ] C06F12 Puro [ molecules ] ;molecule name nr. C06F12 500