* CHARMM
*
BOMLEV -2

read rtf card name "parmff14SB_1okl.rtf" unit 1
read para card name "parmff14SB_1okl.prm" unit 1 append

read psf card name "1OKL_solv.psf" unit 1
read coor card name "1OKL_solv.crd" unit 1

NBONd   elec atom cdie eps 1.0 switch -
       vdw vatom vdis wmin 1.0 vswitch -
       CUTNb  999.0  CTOFnb  999.0  CTONnb  999.0

ener
coor force comp
print coor comp

stop

