# a fcc lattice dummy title 0 1 C -1.0 0.0 0.0 C 1.0 0.0 0.0 C 0.0 1.73 0.0 C 2.0 1.73 0.0 C -1.0 0.0 2.5 C 1.0 0.0 2.5 C 0.0 1.73 2.5 C 2.0 1.73 2.5