rc = 5.0 delr = 0.1 augt1 = 0 erose_form = 2 zbl(1,1) = 0 nn2(1,1) = 1 Ec(1,1) = 3.0500 re(1,1) = 3.4800 attrac(1,1) = 0.0200 repuls(1,1) = 0.0200 Cmin(1,1,1) = 1.2900 Cmax(1,1,1) = 4.4300