SystemName = "C2H2" Units = "eVA" CalculationMode = gs_start BoxShape = cylinder Radius = 6 XLength = 6 Spacing = 0.20 %Coordinates "H" | 0.000 | 0.000 | -1.662 | no "C" | 0.000 | 0.000 | -0.593 | no "C" | 0.000 | 0.000 | 0.593 | no "H" | 0.000 | 0.000 | 1.662 | no %