Largest charge group radii for Van der Waals: 0.085, 0.085 nm
Largest charge group radii for Coulomb:       0.085, 0.085 nm
Calculating fourier grid dimensions for X Y Z
Using a fourier grid of 20x20x20, spacing 0.110 0.110 0.110
This run will generate roughly 2 Mb of data
