64 # number of k-points 1.0 # electron density 2 # number of total atomic shells 1 1 2 5 # atom, sort, l, dim 2 2 1 3 # atom, sort, l, dim 1 # number of correlated shells 1 1 2 5 0 0 # atom, sort, l, dim, SO, irep 1 5 # number of ireps, dim of irep